1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2-methoxy-5-methyl-phenoxy)ethanone

Systemtic Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2-methoxy-5-methyl-phenoxy)ethanone Openeye Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2-methoxy-5-methyl-phenoxy)ethanone CAS Name: 1-[4-[(4-chlorophenyl)methyl]-1-piperazinyl]-2-(2-methoxy-5-methylphenoxy)ethanone IUPAC Name: 1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-2-(2-methoxy-5-methylphenoxy)ethanone Traditional Name: 1-[4-(4-chlorobenzyl)piperazino]-2-(2-methoxy-5-methyl-phenoxy)ethanone Formula: C21H25ClN2O3 MolecularWeight: 388.8878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)OC)OCC(=O)N2CCN(CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN2O3/c1-16-3-8-19(26-2)20(13-16)27-15-21(25)24-11-9-23(10-12-24)14-17-4-6-18(22)7-5-17/h3-8,13H,9-12,14-15H2,1-2H3