1-(4-methyl-3-oxidanyl-phenyl)carbonylpiperidine-4-carboxylic acid

Systemtic Name: 1-(4-methyl-3-oxidanyl-phenyl)carbonylpiperidine-4-carboxylic acid Openeye Name: 1-(3-hydroxy-4-methyl-benzoyl)piperidine-4-carboxylic acid CAS Name: 1-[(3-hydroxy-4-methylphenyl)-oxomethyl]-4-piperidinecarboxylic acid IUPAC Name: 1-(3-hydroxy-4-methylbenzoyl)piperidine-4-carboxylic acid Traditional Name: 1-(3-hydroxy-4-methyl-benzoyl)isonipecotic acid Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)O)O

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)O)O

InChI

InChI=1S/C14H17NO4/c1-9-2-3-11(8-12(9)16)13(17)15-6-4-10(5-7-15)14(18)19/h2-3,8,10,16H,4-7H2,1H3,(H,18,19)