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

Systemtic Name: methyl 2-[[(3S)-3-methylpiperazin-1-yl]methyl]benzoate Openeye Name: methyl 2-[[(3S)-3-methylpiperazin-1-yl]methyl]benzoate CAS Name: 2-[[(3S)-3-methyl-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[(3S)-3-methylpiperazin-1-yl]methyl]benzoate Traditional Name: 2-[[(3S)-3-methylpiperazino]methyl]benzoic acid methyl ester Formula: C14H20N2O2 MolecularWeight: 248.3208

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)CC2=CC=CC=C2C(=O)OC

Isomeric SMILES

C[C@H]1CN(CCN1)CC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C14H20N2O2/c1-11-9-16(8-7-15-11)10-12-5-3-4-6-13(12)14(17)18-2/h3-6,11,15H,7-10H2,1-2H3/t11-/m0/s1