2-(4-chloranyl-3-methyl-phenoxy)-N-[4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]phenyl]ethanamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-[4-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]phenyl]ethanamide Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-N-[4-[4-(4-ethylbenzoyl)piperazin-1-yl]phenyl]acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-[4-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]phenyl]acetamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-[4-[4-(4-ethylbenzoyl)piperazin-1-yl]phenyl]acetamide Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-N-[4-[4-(4-ethylbenzoyl)piperazino]phenyl]acetamide Formula: C28H30ClN3O3 MolecularWeight: 492.0091

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)COC4=CC(=C(C=C4)Cl)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)COC4=CC(=C(C=C4)Cl)C

InChI

InChI=1S/C28H30ClN3O3/c1-3-21-4-6-22(7-5-21)28(34)32-16-14-31(15-17-32)24-10-8-23(9-11-24)30-27(33)19-35-25-12-13-26(29)20(2)18-25/h4-13,18H,3,14-17,19H2,1-2H3,(H,30,33)