3-[[4-(cyclohexylcarbonylamino)phenyl]sulfonylamino]benzoic acid

Systemtic Name: 3-[[4-(cyclohexylcarbonylamino)phenyl]sulfonylamino]benzoic acid Openeye Name: 3-[[4-(cyclohexanecarbonylamino)phenyl]sulfonylamino]benzoic acid CAS Name: 3-[[4-[[cyclohexyl(oxo)methyl]amino]phenyl]sulfonylamino]benzoic acid IUPAC Name: 3-[[4-(cyclohexanecarbonylamino)phenyl]sulfonylamino]benzoic acid Traditional Name: 3-[[4-(cyclohexanecarbonylamino)phenyl]sulfonylamino]benzoic acid Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C20H22N2O5S/c23-19(14-5-2-1-3-6-14)21-16-9-11-18(12-10-16)28(26,27)22-17-8-4-7-15(13-17)20(24)25/h4,7-14,22H,1-3,5-6H2,(H,21,23)(H,24,25)