1-(4-propan-2-ylphenyl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(4-propan-2-ylphenyl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(4-isopropylbenzoyl)piperidine-4-carboxylic acid CAS Name: 1-[oxo-(4-propan-2-ylphenyl)methyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(4-propan-2-ylbenzoyl)piperidine-4-carboxylic acid Traditional Name: 1-cumoylisonipecotic acid Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCC(CC2)C(=O)O

InChI

InChI=1S/C16H21NO3/c1-11(2)12-3-5-13(6-4-12)15(18)17-9-7-14(8-10-17)16(19)20/h3-6,11,14H,7-10H2,1-2H3,(H,19,20)