N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-3-(2-oxidanylidenechromen-3-yl)benzamide

Systemtic Name: N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-3-(2-oxidanylidenechromen-3-yl)benzamide Openeye Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-3-(2-oxochromen-3-yl)benzamide CAS Name: N-[3-chloro-4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-3-(2-oxo-1-benzopyran-3-yl)benzamide IUPAC Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-3-(2-oxochromen-3-yl)benzamide Traditional Name: N-[3-chloro-4-(4-o-toluoylpiperazino)phenyl]-3-(2-ketochromen-3-yl)benzamide Formula: C34H28ClN3O4 MolecularWeight: 578.05682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC(=C4)C5=CC6=CC=CC=C6OC5=O)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC(=C4)C5=CC6=CC=CC=C6OC5=O)Cl

InChI

InChI=1S/C34H28ClN3O4/c1-22-7-2-4-11-27(22)33(40)38-17-15-37(16-18-38)30-14-13-26(21-29(30)35)36-32(39)25-10-6-9-23(19-25)28-20-24-8-3-5-12-31(24)42-34(28)41/h2-14,19-21H,15-18H2,1H3,(H,36,39)