2-[[(3R)-3-methylpiperazin-1-yl]methyl]benzoic acid

Systemtic Name: 2-[[(3R)-3-methylpiperazin-1-yl]methyl]benzoic acid Openeye Name: 2-[[(3R)-3-methylpiperazin-1-yl]methyl]benzoic acid CAS Name: 2-[[(3R)-3-methyl-1-piperazinyl]methyl]benzoic acid IUPAC Name: 2-[[(3R)-3-methylpiperazin-1-yl]methyl]benzoic acid Traditional Name: 2-[[(3R)-3-methylpiperazino]methyl]benzoic acid Formula: C13H18N2O2 MolecularWeight: 234.29422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18N2O2/c1-10-8-15(7-6-14-10)9-11-4-2-3-5-12(11)13(16)17/h2-5,10,14H,6-9H2,1H3,(H,16,17)/t10-/m1/s1