3-(4-propan-2-ylpiperazin-1-yl)benzoic acid

Systemtic Name: 3-(4-propan-2-ylpiperazin-1-yl)benzoic acid Openeye Name: 3-(4-isopropylpiperazin-1-yl)benzoic acid CAS Name: 3-(4-propan-2-yl-1-piperazinyl)benzoic acid IUPAC Name: 3-(4-propan-2-ylpiperazin-1-yl)benzoic acid Traditional Name: 3-(4-isopropylpiperazino)benzoic acid Formula: C14H20N2O2 MolecularWeight: 248.3208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC(C)N1CCN(CC1)C2=CC=CC(=C2)C(=O)O

InChI

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