4-[(3,5-ditert-butylphenyl)carbamoyl]benzoic acid

Systemtic Name: 4-[(3,5-ditert-butylphenyl)carbamoyl]benzoic acid Openeye Name: 4-[(3,5-ditert-butylphenyl)carbamoyl]benzoic acid CAS Name: 4-[(3,5-ditert-butylanilino)-oxomethyl]benzoic acid IUPAC Name: 4-[(3,5-ditert-butylphenyl)carbamoyl]benzoic acid Traditional Name: 4-[(3,5-ditert-butylphenyl)carbamoyl]benzoic acid Formula: C22H27NO3 MolecularWeight: 353.45468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)C(=O)O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)NC(=O)C2=CC=C(C=C2)C(=O)O)C(C)(C)C

InChI

InChI=1S/C22H27NO3/c1-21(2,3)16-11-17(22(4,5)6)13-18(12-16)23-19(24)14-7-9-15(10-8-14)20(25)26/h7-13H,1-6H3,(H,23,24)(H,25,26)