1-[4-[4-[3-[(3-methylphenyl)methoxy]phenyl]carbonylpiperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[3-[(3-methylphenyl)methoxy]phenyl]carbonylpiperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-[3-(m-tolylmethoxy)benzoyl]piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[[3-[(3-methylphenyl)methoxy]phenyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-[3-[(3-methylphenyl)methoxy]benzoyl]piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-[3-(3-methylbenzyl)oxybenzoyl]piperazino]phenyl]ethanone Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)COC2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C27H28N2O3/c1-20-5-3-6-22(17-20)19-32-26-8-4-7-24(18-26)27(31)29-15-13-28(14-16-29)25-11-9-23(10-12-25)21(2)30/h3-12,17-18H,13-16,19H2,1-2H3