4-[4-(2,2-dimethylpropyl)piperazin-1-yl]benzoic acid

Systemtic Name: 4-[4-(2,2-dimethylpropyl)piperazin-1-yl]benzoic acid Openeye Name: 4-[4-(2,2-dimethylpropyl)piperazin-1-yl]benzoic acid CAS Name: 4-[4-(2,2-dimethylpropyl)-1-piperazinyl]benzoic acid IUPAC Name: 4-[4-(2,2-dimethylpropyl)piperazin-1-yl]benzoic acid Traditional Name: 4-(4-neopentylpiperazino)benzoic acid Formula: C16H24N2O2 MolecularWeight: 276.37396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1CCN(CC1)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC(C)(C)CN1CCN(CC1)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H24N2O2/c1-16(2,3)12-17-8-10-18(11-9-17)14-6-4-13(5-7-14)15(19)20/h4-7H,8-12H2,1-3H3,(H,19,20)