N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-3,4,5-triethoxy-benzamide

Systemtic Name: N-[3-chloranyl-4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-3,4,5-triethoxy-benzamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chloro-phenyl]-3,4,5-triethoxy-benzamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)-3-chlorophenyl]-3,4,5-triethoxybenzamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)-3-chlorophenyl]-3,4,5-triethoxybenzamide Traditional Name: N-[4-(4-benzoylpiperazino)-3-chloro-phenyl]-3,4,5-triethoxy-benzamide Formula: C30H34ClN3O5 MolecularWeight: 552.06106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4)Cl

InChI

InChI=1S/C30H34ClN3O5/c1-4-37-26-18-22(19-27(38-5-2)28(26)39-6-3)29(35)32-23-12-13-25(24(31)20-23)33-14-16-34(17-15-33)30(36)21-10-8-7-9-11-21/h7-13,18-20H,4-6,14-17H2,1-3H3,(H,32,35)