2-[4-(2,4-dimethylphenyl)piperazin-1-yl]carbonylbenzoate

Systemtic Name: 2-[4-(2,4-dimethylphenyl)piperazin-1-yl]carbonylbenzoate Openeye Name: 2-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]benzoate CAS Name: 2-[[4-(2,4-dimethylphenyl)-1-piperazinyl]-oxomethyl]benzoate IUPAC Name: 2-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]benzoate Traditional Name: 2-[4-(2,4-dimethylphenyl)piperazine-1-carbonyl]benzoate Formula: C20H21N2O3- MolecularWeight: 337.39234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC=CC=C3C(=O)[O-])C

InChI

InChI=1S/C20H22N2O3/c1-14-7-8-18(15(2)13-14)21-9-11-22(12-10-21)19(23)16-5-3-4-6-17(16)20(24)25/h3-8,13H,9-12H2,1-2H3,(H,24,25)/p-1