6-[3-(dimethylamino)phenyl]-1-(4-methylphenyl)sulfonyl-6-phenyl-7H-indazole-3-carboxylic acid

Systemtic Name: 6-[3-(dimethylamino)phenyl]-1-(4-methylphenyl)sulfonyl-6-phenyl-7H-indazole-3-carboxylic acid Openeye Name: 6-[3-(dimethylamino)phenyl]-6-phenyl-1-(p-tolylsulfonyl)-7H-indazole-3-carboxylic acid CAS Name: 6-[3-(dimethylamino)phenyl]-1-(4-methylphenyl)sulfonyl-6-phenyl-7H-indazole-3-carboxylic acid IUPAC Name: 6-[3-(dimethylamino)phenyl]-1-(4-methylphenyl)sulfonyl-6-phenyl-7H-indazole-3-carboxylic acid Traditional Name: 6-[3-(dimethylamino)phenyl]-6-phenyl-1-tosyl-7H-indazole-3-carboxylic acid Formula: C29H27N3O4S MolecularWeight: 513.60738

Click to see the large picture

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(=CC=C5)N(C)C)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(=CC=C5)N(C)C)C(=N2)C(=O)O

InChI

InChI=1S/C29H27N3O4S/c1-20-12-14-24(15-13-20)37(35,36)32-26-19-29(21-8-5-4-6-9-21,17-16-25(26)27(30-32)28(33)34)22-10-7-11-23(18-22)31(2)3/h4-18H,19H2,1-3H3,(H,33,34)