4-[[[3,4-bis(oxidanyl)phenyl]carbonylamino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[[3,4-bis(oxidanyl)phenyl]carbonylamino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[(3,4-dihydroxybenzoyl)amino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[(3,4-dihydroxyphenyl)-oxomethyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[(3,4-dihydroxybenzoyl)amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[(protocatechuoylamino)methyl]cyclohexanecarboxylic acid Formula: C15H19NO5 MolecularWeight: 293.31506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC(=O)C2=CC(=C(C=C2)O)O)C(=O)O

Isomeric SMILES

C1CC(CCC1CNC(=O)C2=CC(=C(C=C2)O)O)C(=O)O

InChI

InChI=1S/C15H19NO5/c17-12-6-5-11(7-13(12)18)14(19)16-8-9-1-3-10(4-2-9)15(20)21/h5-7,9-10,17-18H,1-4,8H2,(H,16,19)(H,20,21)