3-methoxy-4-[[6-(2-phenylbutanoylamino)indazol-2-yl]methyl]benzoic acid

Systemtic Name: 3-methoxy-4-[[6-(2-phenylbutanoylamino)indazol-2-yl]methyl]benzoic acid Openeye Name: 3-methoxy-4-[[6-(2-phenylbutanoylamino)indazol-2-yl]methyl]benzoic acid CAS Name: 3-methoxy-4-[[6-[(1-oxo-2-phenylbutyl)amino]-2-indazolyl]methyl]benzoic acid IUPAC Name: 3-methoxy-4-[[6-(2-phenylbutanoylamino)indazol-2-yl]methyl]benzoic acid Traditional Name: 3-methoxy-4-[[6-(2-phenylbutanoylamino)indazol-2-yl]methyl]benzoic acid Formula: C26H25N3O4 MolecularWeight: 443.4944

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC3=NN(C=C3C=C2)CC4=C(C=C(C=C4)C(=O)O)OC

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CC3=NN(C=C3C=C2)CC4=C(C=C(C=C4)C(=O)O)OC

InChI

InChI=1S/C26H25N3O4/c1-3-22(17-7-5-4-6-8-17)25(30)27-21-12-11-19-15-29(28-23(19)14-21)16-20-10-9-18(26(31)32)13-24(20)33-2/h4-15,22H,3,16H2,1-2H3,(H,27,30)(H,31,32)