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

Systemtic Name: methyl 4-[[(3S)-3-(phenylmethyl)piperazin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[(3S)-3-benzylpiperazin-1-yl]methyl]benzoate CAS Name: 4-[[(3S)-3-(phenylmethyl)-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3S)-3-benzylpiperazin-1-yl]methyl]benzoate Traditional Name: 4-[[(3S)-3-benzylpiperazino]methyl]benzoic acid methyl ester Formula: C20H24N2O2 MolecularWeight: 324.41676

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCNC(C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCN[C@H](C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O2/c1-24-20(23)18-9-7-17(8-10-18)14-22-12-11-21-19(15-22)13-16-5-3-2-4-6-16/h2-10,19,21H,11-15H2,1H3/t19-/m0/s1