1-(4-methylphenyl)sulfonyl-6-phenyl-6-(3,4,5-trimethoxyphenyl)-7H-indazole-3-carboxylic acid

Systemtic Name: 1-(4-methylphenyl)sulfonyl-6-phenyl-6-(3,4,5-trimethoxyphenyl)-7H-indazole-3-carboxylic acid Openeye Name: 6-phenyl-1-(p-tolylsulfonyl)-6-(3,4,5-trimethoxyphenyl)-7H-indazole-3-carboxylic acid CAS Name: 1-(4-methylphenyl)sulfonyl-6-phenyl-6-(3,4,5-trimethoxyphenyl)-7H-indazole-3-carboxylic acid IUPAC Name: 1-(4-methylphenyl)sulfonyl-6-phenyl-6-(3,4,5-trimethoxyphenyl)-7H-indazole-3-carboxylic acid Traditional Name: 6-phenyl-1-tosyl-6-(3,4,5-trimethoxyphenyl)-7H-indazole-3-carboxylic acid Formula: C30H28N2O7S MolecularWeight: 560.61752

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=CC(C3)(C4=CC=CC=C4)C5=CC(=C(C(=C5)OC)OC)OC)C(=N2)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C3=C(C=CC(C3)(C4=CC=CC=C4)C5=CC(=C(C(=C5)OC)OC)OC)C(=N2)C(=O)O

InChI

InChI=1S/C30H28N2O7S/c1-19-10-12-22(13-11-19)40(35,36)32-24-18-30(20-8-6-5-7-9-20,15-14-23(24)27(31-32)29(33)34)21-16-25(37-2)28(39-4)26(17-21)38-3/h5-17H,18H2,1-4H3,(H,33,34)