1-[4-(2-azanyl-2-oxidanylidene-ethoxy)naphthalen-1-yl]-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid

Systemtic Name: 1-[4-(2-azanyl-2-oxidanylidene-ethoxy)naphthalen-1-yl]-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Openeye Name: 1-[4-(2-amino-2-oxo-ethoxy)-1-naphthyl]-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid CAS Name: 1-[4-(2-amino-2-oxoethoxy)-1-naphthalenyl]-5-(2,6-dimethoxyphenyl)-3-pyrazolecarboxylic acid IUPAC Name: 1-[4-(2-amino-2-oxoethoxy)naphthalen-1-yl]-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Traditional Name: 1-[4-(2-amino-2-keto-ethoxy)-1-naphthyl]-5-(2,6-dimethoxyphenyl)pyrazole-3-carboxylic acid Formula: C24H21N3O6 MolecularWeight: 447.44004

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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)OCC(=O)N)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C24H21N3O6/c1-31-20-8-5-9-21(32-2)23(20)18-12-16(24(29)30)26-27(18)17-10-11-19(33-13-22(25)28)15-7-4-3-6-14(15)17/h3-12H,13H2,1-2H3,(H2,25,28)(H,29,30)