2-[2-[(4-methyl-2-oxidanyl-cyclohexyl)amino]phenyl]carbonylbenzoic acid

Systemtic Name: 2-[2-[(4-methyl-2-oxidanyl-cyclohexyl)amino]phenyl]carbonylbenzoic acid Openeye Name: 2-[2-[(2-hydroxy-4-methyl-cyclohexyl)amino]benzoyl]benzoic acid CAS Name: 2-[[2-[(2-hydroxy-4-methylcyclohexyl)amino]phenyl]-oxomethyl]benzoic acid IUPAC Name: 2-[2-[(2-hydroxy-4-methylcyclohexyl)amino]benzoyl]benzoic acid Traditional Name: 2-[2-[(2-hydroxy-4-methyl-cyclohexyl)amino]benzoyl]benzoic acid Formula: C21H23NO4 MolecularWeight: 353.41162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC1CCC(C(C1)O)NC2=CC=CC=C2C(=O)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C21H23NO4/c1-13-10-11-18(19(23)12-13)22-17-9-5-4-8-16(17)20(24)14-6-2-3-7-15(14)21(25)26/h2-9,13,18-19,22-23H,10-12H2,1H3,(H,25,26)