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3-[2-(hydroxymethyl)-1-methyl-piperidin-1-ium-1-yl]-N-[6-[3-[2-(hydroxymethyl)-1-methyl-piperidin-1-ium-1-yl]propanoylamino]-9,10-bis(oxidanylidene)anthracen-2-yl]propanamide

3-[2-(hydroxymethyl)-1-methyl-piperidin-1-ium-1-yl]-N-[6-[3-[2-(hydroxymethyl)-1-methyl-piperidin-1-ium-1-yl]propanoylamino]-9,10-bis(oxidanylidene)anthracen-2-yl]propanamide

Systemtic Name:3-[2-(hydroxymethyl)-1-methyl-piperidin-1-ium-1-yl]-N-[6-[3-[2-(hydroxymethyl)-1-methyl-piperidin-1-ium-1-yl]propanoylamino]-9,10-bis(oxidanylidene)anthracen-2-yl]propanamide
Openeye Name:3-[2-(hydroxymethyl)-1-methyl-piperidin-1-ium-1-yl]-N-[6-[3-[2-(hydroxymethyl)-1-methyl-piperidin-1-ium-1-yl]propanoylamino]-9,10-dioxo-2-anthryl]propanamide
CAS Name:3-[2-(hydroxymethyl)-1-methyl-1-piperidin-1-iumyl]-N-[6-[[3-[2-(hydroxymethyl)-1-methyl-1-piperidin-1-iumyl]-1-oxopropyl]amino]-9,10-dioxo-2-anthracenyl]propanamide
IUPAC Name:3-[2-(hydroxymethyl)-1-methylpiperidin-1-ium-1-yl]-N-[6-[3-[2-(hydroxymethyl)-1-methylpiperidin-1-ium-1-yl]propanoylamino]-9,10-dioxoanthracen-2-yl]propanamide
Traditional Name:N-[9,10-diketo-6-[3-(1-methyl-2-methylol-piperidin-1-ium-1-yl)propanoylamino]-2-anthryl]-3-(1-methyl-2-methylol-piperidin-1-ium-1-yl)propionamide
Formula: C34H46N4O6+2
MolecularWeight: 606.75224
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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1CO)CCC(=O)NC2=CC3=C(C=C2)C(=O)C4=C(C3=O)C=CC(=C4)NC(=O)CC[N+]5(CCCCC5CO)C


Isomeric SMILES

C[N+]1(CCCCC1CO)CCC(=O)NC2=CC3=C(C=C2)C(=O)C4=C(C3=O)C=CC(=C4)NC(=O)CC[N+]5(CCCCC5CO)C


InChI

InChI=1S/C34H44N4O6/c1-37(15-5-3-7-25(37)21-39)17-13-31(41)35-23-9-11-27-29(19-23)33(43)28-12-10-24(20-30(28)34(27)44)36-32(42)14-18-38(2)16-6-4-8-26(38)22-40/h9-12,19-20,25-26,39-40H,3-8,13-18,21-22H2,1-2H3/p+2


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Name: 3-[2-(hydroxymethyl)-1-methyl-piperidin-1-ium-1-yl]-N-[6-[3-[2-(hydroxymethyl)-1-methyl-piperidin-1-ium-1-yl]propanoylamino]-9,10-bis(oxidanylidene)anthracen-2-yl]propanamide

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