ethyl 5-[3-(butanoylamino)phenyl]-1-(4-methoxyphenyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 5-[3-(butanoylamino)phenyl]-1-(4-methoxyphenyl)pyrazole-3-carboxylate Openeye Name: ethyl 5-[3-(butanoylamino)phenyl]-1-(4-methoxyphenyl)pyrazole-3-carboxylate CAS Name: 1-(4-methoxyphenyl)-5-[3-(1-oxobutylamino)phenyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(butanoylamino)phenyl]-1-(4-methoxyphenyl)pyrazole-3-carboxylate Traditional Name: 5-(3-butyramidophenyl)-1-(4-methoxyphenyl)pyrazole-3-carboxylic acid ethyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=CC(=C1)C2=CC(=NN2C3=CC=C(C=C3)OC)C(=O)OCC

Isomeric SMILES

CCCC(=O)NC1=CC=CC(=C1)C2=CC(=NN2C3=CC=C(C=C3)OC)C(=O)OCC

InChI

InChI=1S/C23H25N3O4/c1-4-7-22(27)24-17-9-6-8-16(14-17)21-15-20(23(28)30-5-2)25-26(21)18-10-12-19(29-3)13-11-18/h6,8-15H,4-5,7H2,1-3H3,(H,24,27)