4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-(pyrazol-1-ylmethyl)quinoline-3-carboxylic acid

Systemtic Name: 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-(pyrazol-1-ylmethyl)quinoline-3-carboxylic acid Openeye Name: 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-(pyrazol-1-ylmethyl)quinoline-3-carboxylic acid CAS Name: 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-(1-pyrazolylmethyl)-3-quinolinecarboxylic acid IUPAC Name: 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-(pyrazol-1-ylmethyl)quinoline-3-carboxylic acid Traditional Name: 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-(pyrazol-1-ylmethyl)quinoline-3-carboxylic acid Formula: C24H23N3O6 MolecularWeight: 449.45592

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=C(C(=NC3=CC(=C(C=C32)OC)OC)CN4C=CC=N4)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=C(C(=NC3=CC(=C(C=C32)OC)OC)CN4C=CC=N4)C(=O)O)OC

InChI

InChI=1S/C24H23N3O6/c1-30-18-7-6-14(10-19(18)31-2)22-15-11-20(32-3)21(33-4)12-16(15)26-17(23(22)24(28)29)13-27-9-5-8-25-27/h5-12H,13H2,1-4H3,(H,28,29)