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

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-4-ium-1-yl]carbonylphenyl]propanamide Openeye Name: N-[2-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]propanamide CAS Name: N-[2-[oxo-[4-(phenylmethyl)-1-piperazin-4-iumyl]methyl]phenyl]propanamide IUPAC Name: N-[2-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]propanamide Traditional Name: N-[2-(4-benzylpiperazin-4-ium-1-carbonyl)phenyl]propionamide Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC=C1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CCC(=O)NC1=CC=CC=C1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2/c1-2-20(25)22-19-11-7-6-10-18(19)21(26)24-14-12-23(13-15-24)16-17-8-4-3-5-9-17/h3-11H,2,12-16H2,1H3,(H,22,25)/p+1