N-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]propanamide

Systemtic Name: N-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]propanamide Openeye Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]propanamide CAS Name: N-[2-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]phenyl]propanamide IUPAC Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]propanamide Traditional Name: N-[2-(4-benzhydrylpiperazin-4-ium-1-carbonyl)phenyl]propionamide Formula: C27H30N3O2+ MolecularWeight: 428.546

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC=C1C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCC(=O)NC1=CC=CC=C1C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H29N3O2/c1-2-25(31)28-24-16-10-9-15-23(24)27(32)30-19-17-29(18-20-30)26(21-11-5-3-6-12-21)22-13-7-4-8-14-22/h3-16,26H,2,17-20H2,1H3,(H,28,31)/p+1