4-ethyl-N-[(2R)-3-methyl-1-oxidanylidene-1-(4-piperidin-1-ium-1-ylpiperidin-1-yl)butan-2-yl]benzamide

Systemtic Name: 4-ethyl-N-[(2R)-3-methyl-1-oxidanylidene-1-(4-piperidin-1-ium-1-ylpiperidin-1-yl)butan-2-yl]benzamide Openeye Name: 4-ethyl-N-[(1R)-2-methyl-1-(4-piperidin-1-ium-1-ylpiperidine-1-carbonyl)propyl]benzamide CAS Name: 4-ethyl-N-[(2R)-3-methyl-1-oxo-1-[4-(1-piperidin-1-iumyl)-1-piperidinyl]butan-2-yl]benzamide IUPAC Name: 4-ethyl-N-[(2R)-3-methyl-1-oxo-1-(4-piperidin-1-ium-1-ylpiperidin-1-yl)butan-2-yl]benzamide Traditional Name: 4-ethyl-N-[(1R)-2-methyl-1-(4-piperidin-1-ium-1-ylpiperidine-1-carbonyl)propyl]benzamide Formula: C24H38N3O2+ MolecularWeight: 400.57742

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(C(C)C)C(=O)N2CCC(CC2)[NH+]3CCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N[C@H](C(C)C)C(=O)N2CCC(CC2)[NH+]3CCCCC3

InChI

InChI=1S/C24H37N3O2/c1-4-19-8-10-20(11-9-19)23(28)25-22(18(2)3)24(29)27-16-12-21(13-17-27)26-14-6-5-7-15-26/h8-11,18,21-22H,4-7,12-17H2,1-3H3,(H,25,28)/p+1/t22-/m1/s1