N-(4-methylphenyl)-2-[4-[2-(phenoxymethyl)phenyl]carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(4-methylphenyl)-2-[4-[2-(phenoxymethyl)phenyl]carbonylpiperazin-1-yl]ethanamide Openeye Name: 2-[4-[2-(phenoxymethyl)benzoyl]piperazin-1-yl]-N-(p-tolyl)acetamide CAS Name: N-(4-methylphenyl)-2-[4-[oxo-[2-(phenoxymethyl)phenyl]methyl]-1-piperazinyl]acetamide IUPAC Name: N-(4-methylphenyl)-2-[4-[2-(phenoxymethyl)benzoyl]piperazin-1-yl]acetamide Traditional Name: 2-[4-[2-(phenoxymethyl)benzoyl]piperazino]-N-(p-tolyl)acetamide Formula: C27H29N3O3 MolecularWeight: 443.53746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)C3=CC=CC=C3COC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CN2CCN(CC2)C(=O)C3=CC=CC=C3COC4=CC=CC=C4

InChI

InChI=1S/C27H29N3O3/c1-21-11-13-23(14-12-21)28-26(31)19-29-15-17-30(18-16-29)27(32)25-10-6-5-7-22(25)20-33-24-8-3-2-4-9-24/h2-14H,15-20H2,1H3,(H,28,31)