ethyl 1-[4-[(3-ethoxycarbonylphenyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[(3-ethoxycarbonylphenyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[(3-ethoxycarbonylphenyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[(3-ethoxycarbonylanilino)-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(3-ethoxycarbonylphenyl)carbamoyl]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[4-[(3-carbethoxyphenyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OCC)C

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OCC)C

InChI

InChI=1S/C23H23N3O5/c1-4-30-22(28)17-7-6-8-18(13-17)25-21(27)16-9-11-19(12-10-16)26-15(3)20(14-24-26)23(29)31-5-2/h6-14H,4-5H2,1-3H3,(H,25,27)