2-[5-azanyl-1-(4-methylphenyl)-4-sulfino-indazol-3-yl]oxy-2-(4-chlorophenyl)ethanoic acid

Systemtic Name: 2-[5-azanyl-1-(4-methylphenyl)-4-sulfino-indazol-3-yl]oxy-2-(4-chlorophenyl)ethanoic acid Openeye Name: 2-[5-amino-1-(p-tolyl)-4-sulfino-indazol-3-yl]oxy-2-(4-chlorophenyl)acetic acid CAS Name: 2-[[5-amino-1-(4-methylphenyl)-4-sulfino-3-indazolyl]oxy]-2-(4-chlorophenyl)acetic acid IUPAC Name: 2-[5-amino-1-(4-methylphenyl)-4-sulfinoindazol-3-yl]oxy-2-(4-chlorophenyl)acetic acid Traditional Name: 2-[5-amino-1-(p-tolyl)-4-sulfino-indazol-3-yl]oxy-2-(4-chlorophenyl)acetic acid Formula: C22H18ClN3O5S MolecularWeight: 471.91342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18ClN3O5S/c1-12-2-8-15(9-3-12)26-17-11-10-16(24)20(32(29)30)18(17)21(25-26)31-19(22(27)28)13-4-6-14(23)7-5-13/h2-11,19H,24H2,1H3,(H,27,28)(H,29,30)