2-[(2,5-dimethylphenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid

Systemtic Name: 2-[(2,5-dimethylphenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid Openeye Name: 2-[(2,5-dimethylphenyl)methylcarbamoyl]cyclohexanecarboxylic acid CAS Name: 2-[[(2,5-dimethylphenyl)methylamino]-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 2-[(2,5-dimethylphenyl)methylcarbamoyl]cyclohexane-1-carboxylic acid Traditional Name: 2-[(2,5-dimethylbenzyl)carbamoyl]cyclohexanecarboxylic acid Formula: C17H23NO3 MolecularWeight: 289.36942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CNC(=O)C2CCCCC2C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)CNC(=O)C2CCCCC2C(=O)O

InChI

InChI=1S/C17H23NO3/c1-11-7-8-12(2)13(9-11)10-18-16(19)14-5-3-4-6-15(14)17(20)21/h7-9,14-15H,3-6,10H2,1-2H3,(H,18,19)(H,20,21)