1-(4-azanylnaphthalen-1-yl)-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-(4-azanylnaphthalen-1-yl)-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Openeye Name: 1-(4-amino-1-naphthyl)-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid CAS Name: 1-(4-amino-1-naphthalenyl)-5-(2,6-dimethoxyphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-(4-aminonaphthalen-1-yl)-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Traditional Name: 1-(4-amino-1-naphthyl)-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C2=CC(=NN2C3=CC=C(C4=CC=CC=C43)N)C(=O)O

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C2=CC(=NN2C3=CC=C(C4=CC=CC=C43)N)C(=O)O

InChI

InChI=1S/C22H19N3O4/c1-28-19-8-5-9-20(29-2)21(19)18-12-16(22(26)27)24-25(18)17-11-10-15(23)13-6-3-4-7-14(13)17/h3-12H,23H2,1-2H3,(H,26,27)