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

Systemtic Name: 5-(2,6-dimethoxyphenyl)-4-naphthalen-1-yl-1-(propanoylamino)pyrazole-3-carboxylic acid Openeye Name: 5-(2,6-dimethoxyphenyl)-4-(1-naphthyl)-1-(propanoylamino)pyrazole-3-carboxylic acid CAS Name: 5-(2,6-dimethoxyphenyl)-4-(1-naphthalenyl)-1-(1-oxopropylamino)-3-pyrazolecarboxylic acid IUPAC Name: 5-(2,6-dimethoxyphenyl)-4-naphthalen-1-yl-1-(propanoylamino)pyrazole-3-carboxylic acid Traditional Name: 5-(2,6-dimethoxyphenyl)-4-(1-naphthyl)-1-propionamido-pyrazole-3-carboxylic acid Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NN1C(=C(C(=N1)C(=O)O)C2=CC=CC3=CC=CC=C32)C4=C(C=CC=C4OC)OC

Isomeric SMILES

CCC(=O)NN1C(=C(C(=N1)C(=O)O)C2=CC=CC3=CC=CC=C32)C4=C(C=CC=C4OC)OC

InChI

InChI=1S/C25H23N3O5/c1-4-20(29)26-28-24(22-18(32-2)13-8-14-19(22)33-3)21(23(27-28)25(30)31)17-12-7-10-15-9-5-6-11-16(15)17/h5-14H,4H2,1-3H3,(H,26,29)(H,30,31)