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

Systemtic Name: 2-(4-chloranyl-2-methyl-phenoxy)-N-[4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]ethanamide Openeye Name: 2-(4-chloro-2-methyl-phenoxy)-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]acetamide CAS Name: 2-(4-chloro-2-methylphenoxy)-N-[4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]acetamide IUPAC Name: 2-(4-chloro-2-methylphenoxy)-N-[4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]acetamide Traditional Name: 2-(4-chloro-2-methyl-phenoxy)-N-[4-(4-o-toluoylpiperazino)phenyl]acetamide Formula: C27H28ClN3O3 MolecularWeight: 477.98252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)COC4=C(C=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=O)COC4=C(C=C(C=C4)Cl)C

InChI

InChI=1S/C27H28ClN3O3/c1-19-5-3-4-6-24(19)27(33)31-15-13-30(14-16-31)23-10-8-22(9-11-23)29-26(32)18-34-25-12-7-21(28)17-20(25)2/h3-12,17H,13-16,18H2,1-2H3,(H,29,32)