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

Systemtic Name: methyl 4-[(3S)-3-methylpiperazin-1-yl]benzoate Openeye Name: methyl 4-[(3S)-3-methylpiperazin-1-yl]benzoate CAS Name: 4-[(3S)-3-methyl-1-piperazinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3S)-3-methylpiperazin-1-yl]benzoate Traditional Name: 4-[(3S)-3-methylpiperazino]benzoic acid methyl ester Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1)C2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

C[C@H]1CN(CCN1)C2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C13H18N2O2/c1-10-9-15(8-7-14-10)12-5-3-11(4-6-12)13(16)17-2/h3-6,10,14H,7-9H2,1-2H3/t10-/m0/s1