5-methoxy-3-[4-(4-methoxyphenyl)-4-oxidanylidene-butoxy]-1-(4-methylphenyl)indazole-4-sulfinic acid

Systemtic Name: 5-methoxy-3-[4-(4-methoxyphenyl)-4-oxidanylidene-butoxy]-1-(4-methylphenyl)indazole-4-sulfinic acid Openeye Name: 5-methoxy-3-[4-(4-methoxyphenyl)-4-oxo-butoxy]-1-(p-tolyl)indazole-4-sulfinic acid CAS Name: 5-methoxy-3-[4-(4-methoxyphenyl)-4-oxobutoxy]-1-(4-methylphenyl)-4-indazolesulfinic acid IUPAC Name: 5-methoxy-3-[4-(4-methoxyphenyl)-4-oxobutoxy]-1-(4-methylphenyl)indazole-4-sulfinic acid Traditional Name: 3-[4-keto-4-(4-methoxyphenyl)butoxy]-5-methoxy-1-(p-tolyl)indazole-4-sulfinic acid Formula: C26H26N2O6S MolecularWeight: 494.55944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N2O6S/c1-17-6-10-19(11-7-17)28-21-14-15-23(33-3)25(35(30)31)24(21)26(27-28)34-16-4-5-22(29)18-8-12-20(32-2)13-9-18/h6-15H,4-5,16H2,1-3H3,(H,30,31)