3-[(1-cyclopentyl-3-ethyl-indazol-6-yl)-pyridin-3-ylcarbonyl-amino]benzoic acid

Systemtic Name: 3-[(1-cyclopentyl-3-ethyl-indazol-6-yl)-pyridin-3-ylcarbonyl-amino]benzoic acid Openeye Name: 3-[(1-cyclopentyl-3-ethyl-indazol-6-yl)-(pyridine-3-carbonyl)amino]benzoic acid CAS Name: 3-[(1-cyclopentyl-3-ethyl-6-indazolyl)-[oxo(3-pyridinyl)methyl]amino]benzoic acid IUPAC Name: 3-[(1-cyclopentyl-3-ethylindazol-6-yl)-(pyridine-3-carbonyl)amino]benzoic acid Traditional Name: 3-[(1-cyclopentyl-3-ethyl-indazol-6-yl)-nicotinoyl-amino]benzoic acid Formula: C27H26N4O3 MolecularWeight: 454.52034

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C=CC(=C2)N(C3=CC=CC(=C3)C(=O)O)C(=O)C4=CN=CC=C4)C5CCCC5

Isomeric SMILES

CCC1=NN(C2=C1C=CC(=C2)N(C3=CC=CC(=C3)C(=O)O)C(=O)C4=CN=CC=C4)C5CCCC5

InChI

InChI=1S/C27H26N4O3/c1-2-24-23-13-12-22(16-25(23)31(29-24)20-9-3-4-10-20)30(26(32)19-8-6-14-28-17-19)21-11-5-7-18(15-21)27(33)34/h5-8,11-17,20H,2-4,9-10H2,1H3,(H,33,34)