2-[(3R)-3-propan-2-ylpiperazin-1-yl]benzoic acid

Systemtic Name: 2-[(3R)-3-propan-2-ylpiperazin-1-yl]benzoic acid Openeye Name: 2-[(3R)-3-isopropylpiperazin-1-yl]benzoic acid CAS Name: 2-[(3R)-3-propan-2-yl-1-piperazinyl]benzoic acid IUPAC Name: 2-[(3R)-3-propan-2-ylpiperazin-1-yl]benzoic acid Traditional Name: 2-[(3R)-3-isopropylpiperazino]benzoic acid Formula: C14H20N2O2 MolecularWeight: 248.3208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CN(CCN1)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C)[C@@H]1CN(CCN1)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C14H20N2O2/c1-10(2)12-9-16(8-7-15-12)13-6-4-3-5-11(13)14(17)18/h3-6,10,12,15H,7-9H2,1-2H3,(H,17,18)/t12-/m0/s1