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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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