4-[[4-[(4-carboxyphenyl)carbonylamino]cyclohexyl]carbamoyl]benzoic acid

Systemtic Name: 4-[[4-[(4-carboxyphenyl)carbonylamino]cyclohexyl]carbamoyl]benzoic acid Openeye Name: 4-[[4-[(4-carboxybenzoyl)amino]cyclohexyl]carbamoyl]benzoic acid CAS Name: 4-[[[4-[[(4-carboxyphenyl)-oxomethyl]amino]cyclohexyl]amino]-oxomethyl]benzoic acid IUPAC Name: 4-[[4-[(4-carboxybenzoyl)amino]cyclohexyl]carbamoyl]benzoic acid Traditional Name: 4-[[4-[(4-carboxybenzoyl)amino]cyclohexyl]carbamoyl]benzoic acid Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC(=O)C2=CC=C(C=C2)C(=O)O)NC(=O)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C1CC(CCC1NC(=O)C2=CC=C(C=C2)C(=O)O)NC(=O)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C22H22N2O6/c25-19(13-1-5-15(6-2-13)21(27)28)23-17-9-11-18(12-10-17)24-20(26)14-3-7-16(8-4-14)22(29)30/h1-8,17-18H,9-12H2,(H,23,25)(H,24,26)(H,27,28)(H,29,30)