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

Systemtic Name: methyl 2-[[(3S)-3-propylpiperazin-1-yl]methyl]benzoate Openeye Name: methyl 2-[[(3S)-3-propylpiperazin-1-yl]methyl]benzoate CAS Name: 2-[[(3S)-3-propyl-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[(3S)-3-propylpiperazin-1-yl]methyl]benzoate Traditional Name: 2-[[(3S)-3-propylpiperazino]methyl]benzoic acid methyl ester Formula: C16H24N2O2 MolecularWeight: 276.37396

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CN(CCN1)CC2=CC=CC=C2C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C16H24N2O2/c1-3-6-14-12-18(10-9-17-14)11-13-7-4-5-8-15(13)16(19)20-2/h4-5,7-8,14,17H,3,6,9-12H2,1-2H3/t14-/m0/s1