methyl 4-[(3S)-3-(phenylmethyl)piperazin-1-yl]benzoate

Systemtic Name: methyl 4-[(3S)-3-(phenylmethyl)piperazin-1-yl]benzoate Openeye Name: methyl 4-[(3S)-3-benzylpiperazin-1-yl]benzoate CAS Name: 4-[(3S)-3-(phenylmethyl)-1-piperazinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3S)-3-benzylpiperazin-1-yl]benzoate Traditional Name: 4-[(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=C(C=C1)N2CCNC(C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)N2CCN[C@H](C2)CC3=CC=CC=C3

InChI

InChI=1S/C19H22N2O2/c1-23-19(22)16-7-9-18(10-8-16)21-12-11-20-17(14-21)13-15-5-3-2-4-6-15/h2-10,17,20H,11-14H2,1H3/t17-/m0/s1