3-[[(3S)-3-propylpiperazin-1-yl]methyl]benzoic acid

Systemtic Name: 3-[[(3S)-3-propylpiperazin-1-yl]methyl]benzoic acid Openeye Name: 3-[[(3S)-3-propylpiperazin-1-yl]methyl]benzoic acid CAS Name: 3-[[(3S)-3-propyl-1-piperazinyl]methyl]benzoic acid IUPAC Name: 3-[[(3S)-3-propylpiperazin-1-yl]methyl]benzoic acid Traditional Name: 3-[[(3S)-3-propylpiperazino]methyl]benzoic acid Formula: C15H22N2O2 MolecularWeight: 262.34738

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CN(CCN1)CC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCC[C@H]1CN(CCN1)CC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C15H22N2O2/c1-2-4-14-11-17(8-7-16-14)10-12-5-3-6-13(9-12)15(18)19/h3,5-6,9,14,16H,2,4,7-8,10-11H2,1H3,(H,18,19)/t14-/m0/s1