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

Systemtic Name: N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-3-(2-oxidanylidenechromen-3-yl)benzamide Openeye Name: N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-3-(2-oxochromen-3-yl)benzamide CAS Name: N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-3-(2-oxo-1-benzopyran-3-yl)benzamide IUPAC Name: N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-3-(2-oxochromen-3-yl)benzamide Traditional Name: 3-(2-ketochromen-3-yl)-N-[4-(4-o-toluoylpiperazino)phenyl]benzamide Formula: C34H29N3O4 MolecularWeight: 543.61176

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H29N3O4/c1-23-7-2-4-11-29(23)33(39)37-19-17-36(18-20-37)28-15-13-27(14-16-28)35-32(38)26-10-6-9-24(21-26)30-22-25-8-3-5-12-31(25)41-34(30)40/h2-16,21-22H,17-20H2,1H3,(H,35,38)