3-[4-(4-methylphenyl)carbonylpiperazin-1-yl]benzoate

Systemtic Name: 3-[4-(4-methylphenyl)carbonylpiperazin-1-yl]benzoate Openeye Name: 3-[4-(4-methylbenzoyl)piperazin-1-yl]benzoate CAS Name: 3-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]benzoate IUPAC Name: 3-[4-(4-methylbenzoyl)piperazin-1-yl]benzoate Traditional Name: 3-(4-p-toluoylpiperazino)benzoate Formula: C19H19N2O3- MolecularWeight: 323.36576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC(=C3)C(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=CC(=C3)C(=O)[O-]

InChI

InChI=1S/C19H20N2O3/c1-14-5-7-15(8-6-14)18(22)21-11-9-20(10-12-21)17-4-2-3-16(13-17)19(23)24/h2-8,13H,9-12H2,1H3,(H,23,24)/p-1