N-[(Z)-1-phenylethylideneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide

Systemtic Name: N-[(Z)-1-phenylethylideneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Openeye Name: N-[(Z)-1-phenylethylideneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide CAS Name: N-[(Z)-1-phenylethylideneamino]-3-(4-phenyl-1-piperazin-1-iumyl)propanamide IUPAC Name: N-[(Z)-1-phenylethylideneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propanamide Traditional Name: N-[(Z)-1-phenylethylideneamino]-3-(4-phenylpiperazin-1-ium-1-yl)propionamide Formula: C21H27N4O+ MolecularWeight: 351.46528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CC[NH+]1CCN(CC1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

C/C(=N/NC(=O)CC[NH+]1CCN(CC1)C2=CC=CC=C2)/C3=CC=CC=C3

InChI

InChI=1S/C21H26N4O/c1-18(19-8-4-2-5-9-19)22-23-21(26)12-13-24-14-16-25(17-15-24)20-10-6-3-7-11-20/h2-11H,12-17H2,1H3,(H,23,26)/p+1/b22-18-