1-[(E)-3-oxidanylidene-1-phenyl-3-[4-(phenylmethyl)piperazin-4-ium-1-yl]prop-1-en-2-yl]pyridin-2-one

Systemtic Name: 1-[(E)-3-oxidanylidene-1-phenyl-3-[4-(phenylmethyl)piperazin-4-ium-1-yl]prop-1-en-2-yl]pyridin-2-one Openeye Name: 1-[(E)-1-(4-benzylpiperazin-4-ium-1-carbonyl)-2-phenyl-vinyl]pyridin-2-one CAS Name: 1-[(E)-3-oxo-1-phenyl-3-[4-(phenylmethyl)-1-piperazin-4-iumyl]prop-1-en-2-yl]-2-pyridinone IUPAC Name: 1-[(E)-3-(4-benzylpiperazin-4-ium-1-yl)-3-oxo-1-phenylprop-1-en-2-yl]pyridin-2-one Traditional Name: 1-[(E)-1-(4-benzylpiperazin-4-ium-1-carbonyl)-2-phenyl-vinyl]-2-pyridone Formula: C25H26N3O2+ MolecularWeight: 400.49284

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C(=CC3=CC=CC=C3)N4C=CC=CC4=O

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)/C(=C\C3=CC=CC=C3)/N4C=CC=CC4=O

InChI

InChI=1S/C25H25N3O2/c29-24-13-7-8-14-28(24)23(19-21-9-3-1-4-10-21)25(30)27-17-15-26(16-18-27)20-22-11-5-2-6-12-22/h1-14,19H,15-18,20H2/p+1/b23-19+