methyl 3-[4-[(2-methylphenyl)methyl]piperazin-1-yl]carbonylbenzoate

Systemtic Name: methyl 3-[4-[(2-methylphenyl)methyl]piperazin-1-yl]carbonylbenzoate Openeye Name: methyl 3-[4-(o-tolylmethyl)piperazine-1-carbonyl]benzoate CAS Name: 3-[[4-[(2-methylphenyl)methyl]-1-piperazinyl]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[4-[(2-methylphenyl)methyl]piperazine-1-carbonyl]benzoate Traditional Name: 3-[4-(2-methylbenzyl)piperazine-1-carbonyl]benzoic acid methyl ester Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC(=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC(=CC=C3)C(=O)OC

InChI

InChI=1S/C21H24N2O3/c1-16-6-3-4-7-19(16)15-22-10-12-23(13-11-22)20(24)17-8-5-9-18(14-17)21(25)26-2/h3-9,14H,10-13,15H2,1-2H3