3-[2-(2-bromanylphenoxy)ethoxy]-5-methoxy-1-(4-methylphenyl)indazole-4-sulfinate

Systemtic Name: 3-[2-(2-bromanylphenoxy)ethoxy]-5-methoxy-1-(4-methylphenyl)indazole-4-sulfinate Openeye Name: 3-[2-(2-bromophenoxy)ethoxy]-5-methoxy-1-(p-tolyl)indazole-4-sulfinate CAS Name: 3-[2-(2-bromophenoxy)ethoxy]-5-methoxy-1-(4-methylphenyl)-4-indazolesulfinate IUPAC Name: 3-[2-(2-bromophenoxy)ethoxy]-5-methoxy-1-(4-methylphenyl)indazole-4-sulfinate Traditional Name: 3-[2-(2-bromophenoxy)ethoxy]-5-methoxy-1-(p-tolyl)indazole-4-sulfinate Formula: C23H20BrN2O5S- MolecularWeight: 516.3843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C3=C(C(=C(C=C3)OC)S(=O)[O-])C(=N2)OCCOC4=CC=CC=C4Br

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C(=C(C=C3)OC)S(=O)[O-])C(=N2)OCCOC4=CC=CC=C4Br

InChI

InChI=1S/C23H21BrN2O5S/c1-15-7-9-16(10-8-15)26-18-11-12-20(29-2)22(32(27)28)21(18)23(25-26)31-14-13-30-19-6-4-3-5-17(19)24/h3-12H,13-14H2,1-2H3,(H,27,28)/p-1