4-[(5-methoxy-3-oxidanylidene-2H-indazol-1-yl)methyl]benzoic acid

Systemtic Name: 4-[(5-methoxy-3-oxidanylidene-2H-indazol-1-yl)methyl]benzoic acid Openeye Name: 4-[(5-methoxy-3-oxo-2H-indazol-1-yl)methyl]benzoic acid CAS Name: 4-[(5-methoxy-3-oxo-2H-indazol-1-yl)methyl]benzoic acid IUPAC Name: 4-[(5-methoxy-3-oxo-2H-indazol-1-yl)methyl]benzoic acid Traditional Name: 4-[(3-keto-5-methoxy-indazolin-1-yl)methyl]benzoic acid Formula: C16H14N2O4 MolecularWeight: 298.29336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N(NC2=O)CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)N(NC2=O)CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H14N2O4/c1-22-12-6-7-14-13(8-12)15(19)17-18(14)9-10-2-4-11(5-3-10)16(20)21/h2-8H,9H2,1H3,(H,17,19)(H,20,21)