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

Systemtic Name: (E)-N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[3-chloro-2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[3-chloro-2-(4-p-toluoylpiperazino)phenyl]-3-phenyl-acrylamide Formula: C27H26ClN3O2 MolecularWeight: 459.96724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=CC=C3Cl)NC(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H26ClN3O2/c1-20-10-13-22(14-11-20)27(33)31-18-16-30(17-19-31)26-23(28)8-5-9-24(26)29-25(32)15-12-21-6-3-2-4-7-21/h2-15H,16-19H2,1H3,(H,29,32)/b15-12+