2-[[3-(methylcarbamoyl)-1-(oxan-2-yl)indazol-6-yl]amino]benzoic acid

Systemtic Name: 2-[[3-(methylcarbamoyl)-1-(oxan-2-yl)indazol-6-yl]amino]benzoic acid Openeye Name: 2-[[3-(methylcarbamoyl)-1-tetrahydropyran-2-yl-indazol-6-yl]amino]benzoic acid CAS Name: 2-[[3-(methylcarbamoyl)-1-(2-oxanyl)-6-indazolyl]amino]benzoic acid IUPAC Name: 2-[[3-(methylcarbamoyl)-1-(oxan-2-yl)indazol-6-yl]amino]benzoic acid Traditional Name: 2-[[3-(methylcarbamoyl)-1-tetrahydropyran-2-yl-indazol-6-yl]amino]benzoic acid Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C2=C1C=CC(=C2)NC3=CC=CC=C3C(=O)O)C4CCCCO4

Isomeric SMILES

CNC(=O)C1=NN(C2=C1C=CC(=C2)NC3=CC=CC=C3C(=O)O)C4CCCCO4

InChI

InChI=1S/C21H22N4O4/c1-22-20(26)19-15-10-9-13(23-16-7-3-2-6-14(16)21(27)28)12-17(15)25(24-19)18-8-4-5-11-29-18/h2-3,6-7,9-10,12,18,23H,4-5,8,11H2,1H3,(H,22,26)(H,27,28)