(E)-N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[4-(4-o-toluoylpiperazino)phenyl]-3-phenyl-acrylamide Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H27N3O2/c1-21-7-5-6-10-25(21)27(32)30-19-17-29(18-20-30)24-14-12-23(13-15-24)28-26(31)16-11-22-8-3-2-4-9-22/h2-16H,17-20H2,1H3,(H,28,31)/b16-11+