methyl 2-[(3S)-3-(phenylmethyl)piperazin-1-yl]benzoate

Systemtic Name: methyl 2-[(3S)-3-(phenylmethyl)piperazin-1-yl]benzoate Openeye Name: methyl 2-[(3S)-3-benzylpiperazin-1-yl]benzoate CAS Name: 2-[(3S)-3-(phenylmethyl)-1-piperazinyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(3S)-3-benzylpiperazin-1-yl]benzoate Traditional Name: 2-[(3S)-3-benzylpiperazino]benzoic acid methyl ester Formula: C19H22N2O2 MolecularWeight: 310.39018

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N2CCNC(C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1N2CCN[C@H](C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H22N2O2/c1-23-19(22)17-9-5-6-10-18(17)21-12-11-20-16(14-21)13-15-7-3-2-4-8-15/h2-10,16,20H,11-14H2,1H3/t16-/m0/s1