N-[(2S)-2-(4-dimethylaminophenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]propanamide

Systemtic Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]propanamide Openeye Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]propanamide CAS Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-(4-methyl-1-piperazine-1,4-diiumyl)ethyl]propanamide IUPAC Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]propanamide Traditional Name: N-[(2S)-2-(4-dimethylaminophenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]propionamide Formula: C18H32N4O+2 MolecularWeight: 320.47288

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NCC(C1=CC=C(C=C1)N(C)C)[NH+]2CC[NH+](CC2)C

Isomeric SMILES

CCC(=O)NC[C@H](C1=CC=C(C=C1)N(C)C)[NH+]2CC[NH+](CC2)C

InChI

InChI=1S/C18H30N4O/c1-5-18(23)19-14-17(22-12-10-21(4)11-13-22)15-6-8-16(9-7-15)20(2)3/h6-9,17H,5,10-14H2,1-4H3,(H,19,23)/p+2/t17-/m1/s1