N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-2-(3-methylphenoxy)ethanamide

Systemtic Name: N-[3-chloranyl-4-[4-(2-methylphenyl)carbonylpiperazin-1-yl]phenyl]-2-(3-methylphenoxy)ethanamide Openeye Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-2-(3-methylphenoxy)acetamide CAS Name: N-[3-chloro-4-[4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-(3-methylphenoxy)acetamide IUPAC Name: N-[3-chloro-4-[4-(2-methylbenzoyl)piperazin-1-yl]phenyl]-2-(3-methylphenoxy)acetamide Traditional Name: N-[3-chloro-4-(4-o-toluoylpiperazino)phenyl]-2-(3-methylphenoxy)acetamide Formula: C27H28ClN3O3 MolecularWeight: 477.98252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C)Cl

Isomeric SMILES

CC1=CC(=CC=C1)OCC(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C)Cl

InChI

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