N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-3,5-diethoxy-benzamide

Systemtic Name: N-[3-chloranyl-2-[4-(4-methylphenyl)carbonylpiperazin-1-yl]phenyl]-3,5-diethoxy-benzamide Openeye Name: N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-3,5-diethoxy-benzamide CAS Name: N-[3-chloro-2-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-3,5-diethoxybenzamide IUPAC Name: N-[3-chloro-2-[4-(4-methylbenzoyl)piperazin-1-yl]phenyl]-3,5-diethoxybenzamide Traditional Name: N-[3-chloro-2-(4-p-toluoylpiperazino)phenyl]-3,5-diethoxy-benzamide Formula: C29H32ClN3O4 MolecularWeight: 522.03508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)C(=O)NC2=C(C(=CC=C2)Cl)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C)OCC

Isomeric SMILES

CCOC1=CC(=CC(=C1)C(=O)NC2=C(C(=CC=C2)Cl)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C)OCC

InChI

InChI=1S/C29H32ClN3O4/c1-4-36-23-17-22(18-24(19-23)37-5-2)28(34)31-26-8-6-7-25(30)27(26)32-13-15-33(16-14-32)29(35)21-11-9-20(3)10-12-21/h6-12,17-19H,4-5,13-16H2,1-3H3,(H,31,34)