2-(4-chlorophenyl)-2-[3-(indazol-1-ylmethylamino)-5-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-(4-chlorophenyl)-2-[3-(indazol-1-ylmethylamino)-5-methoxy-phenoxy]ethanoic acid Openeye Name: 2-(4-chlorophenyl)-2-[3-(indazol-1-ylmethylamino)-5-methoxy-phenoxy]acetic acid CAS Name: 2-(4-chlorophenyl)-2-[3-(1-indazolylmethylamino)-5-methoxyphenoxy]acetic acid IUPAC Name: 2-(4-chlorophenyl)-2-[3-(indazol-1-ylmethylamino)-5-methoxyphenoxy]acetic acid Traditional Name: 2-(4-chlorophenyl)-2-[3-(indazol-1-ylmethylamino)-5-methoxy-phenoxy]acetic acid Formula: C23H20ClN3O4 MolecularWeight: 437.8756

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NCN2C3=CC=CC=C3C=N2)OC(C4=CC=C(C=C4)Cl)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1)NCN2C3=CC=CC=C3C=N2)OC(C4=CC=C(C=C4)Cl)C(=O)O

InChI

InChI=1S/C23H20ClN3O4/c1-30-19-10-18(25-14-27-21-5-3-2-4-16(21)13-26-27)11-20(12-19)31-22(23(28)29)15-6-8-17(24)9-7-15/h2-13,22,25H,14H2,1H3,(H,28,29)