3-[[cyclohexyl-(2-phenylindazol-3-yl)carbamoyl]amino]benzoic acid

Systemtic Name: 3-[[cyclohexyl-(2-phenylindazol-3-yl)carbamoyl]amino]benzoic acid Openeye Name: 3-[[cyclohexyl-(2-phenylindazol-3-yl)carbamoyl]amino]benzoic acid CAS Name: 3-[[[cyclohexyl-(2-phenyl-3-indazolyl)amino]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[cyclohexyl-(2-phenylindazol-3-yl)carbamoyl]amino]benzoic acid Traditional Name: 3-[[cyclohexyl-(2-phenylindazol-3-yl)carbamoyl]amino]benzoic acid Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2=C3C=CC=CC3=NN2C4=CC=CC=C4)C(=O)NC5=CC=CC(=C5)C(=O)O

Isomeric SMILES

C1CCC(CC1)N(C2=C3C=CC=CC3=NN2C4=CC=CC=C4)C(=O)NC5=CC=CC(=C5)C(=O)O

InChI

InChI=1S/C27H26N4O3/c32-26(33)19-10-9-11-20(18-19)28-27(34)30(21-12-3-1-4-13-21)25-23-16-7-8-17-24(23)29-31(25)22-14-5-2-6-15-22/h2,5-11,14-18,21H,1,3-4,12-13H2,(H,28,34)(H,32,33)