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

Systemtic Name: 2-[[(3S)-3-propylpiperazin-1-yl]methyl]benzoic acid Openeye Name: 2-[[(3S)-3-propylpiperazin-1-yl]methyl]benzoic acid CAS Name: 2-[[(3S)-3-propyl-1-piperazinyl]methyl]benzoic acid IUPAC Name: 2-[[(3S)-3-propylpiperazin-1-yl]methyl]benzoic acid Traditional Name: 2-[[(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=C2C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O2/c1-2-5-13-11-17(9-8-16-13)10-12-6-3-4-7-14(12)15(18)19/h3-4,6-7,13,16H,2,5,8-11H2,1H3,(H,18,19)/t13-/m0/s1