methyl 3-[(2R)-2-(2-methylpropyl)piperazin-1-yl]benzoate

Systemtic Name: methyl 3-[(2R)-2-(2-methylpropyl)piperazin-1-yl]benzoate Openeye Name: methyl 3-[(2R)-2-isobutylpiperazin-1-yl]benzoate CAS Name: 3-[(2R)-2-(2-methylpropyl)-1-piperazinyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(2R)-2-(2-methylpropyl)piperazin-1-yl]benzoate Traditional Name: 3-[(2R)-2-isobutylpiperazino]benzoic acid methyl ester Formula: C16H24N2O2 MolecularWeight: 276.37396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1CNCCN1C2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC(C)C[C@@H]1CNCCN1C2=CC=CC(=C2)C(=O)OC

InChI

InChI=1S/C16H24N2O2/c1-12(2)9-15-11-17-7-8-18(15)14-6-4-5-13(10-14)16(19)20-3/h4-6,10,12,15,17H,7-9,11H2,1-3H3/t15-/m1/s1