2-[4-(phenylmethyl)piperazin-1-ium-1-yl]-N-[(Z)-1-(4-phenylphenyl)ethylideneamino]ethanamide

Systemtic Name: 2-[4-(phenylmethyl)piperazin-1-ium-1-yl]-N-[(Z)-1-(4-phenylphenyl)ethylideneamino]ethanamide Openeye Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[(Z)-1-(4-phenylphenyl)ethylideneamino]acetamide CAS Name: 2-[4-(phenylmethyl)-1-piperazin-1-iumyl]-N-[(Z)-1-(4-phenylphenyl)ethylideneamino]acetamide IUPAC Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[(Z)-1-(4-phenylphenyl)ethylideneamino]acetamide Traditional Name: 2-(4-benzylpiperazin-1-ium-1-yl)-N-[(Z)-1-(4-phenylphenyl)ethylideneamino]acetamide Formula: C27H31N4O+ MolecularWeight: 427.56124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C[NH+]1CCN(CC1)CC2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C/C(=N/NC(=O)C[NH+]1CCN(CC1)CC2=CC=CC=C2)/C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H30N4O/c1-22(24-12-14-26(15-13-24)25-10-6-3-7-11-25)28-29-27(32)21-31-18-16-30(17-19-31)20-23-8-4-2-5-9-23/h2-15H,16-21H2,1H3,(H,29,32)/p+1/b28-22-