3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-5-methoxy-1-(4-methylphenyl)indazole-4-sulfinic acid

Systemtic Name: 3-[(2-chloranyl-6-fluoranyl-phenyl)methoxy]-5-methoxy-1-(4-methylphenyl)indazole-4-sulfinic acid Openeye Name: 3-[(2-chloro-6-fluoro-phenyl)methoxy]-5-methoxy-1-(p-tolyl)indazole-4-sulfinic acid CAS Name: 3-[(2-chloro-6-fluorophenyl)methoxy]-5-methoxy-1-(4-methylphenyl)-4-indazolesulfinic acid IUPAC Name: 3-[(2-chloro-6-fluorophenyl)methoxy]-5-methoxy-1-(4-methylphenyl)indazole-4-sulfinic acid Traditional Name: 3-(2-chloro-6-fluoro-benzyl)oxy-5-methoxy-1-(p-tolyl)indazole-4-sulfinic acid Formula: C22H18ClFN2O4S MolecularWeight: 460.905723

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)OCC4=C(C=CC=C4Cl)F

Isomeric SMILES

CC1=CC=C(C=C1)N2C3=C(C(=C(C=C3)OC)S(=O)O)C(=N2)OCC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C22H18ClFN2O4S/c1-13-6-8-14(9-7-13)26-18-10-11-19(29-2)21(31(27)28)20(18)22(25-26)30-12-15-16(23)4-3-5-17(15)24/h3-11H,12H2,1-2H3,(H,27,28)