ethyl 1-[4-[(2-ethoxyphenyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[(2-ethoxyphenyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[(2-ethoxyphenyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[(2-ethoxyanilino)-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(2-ethoxyphenyl)carbamoyl]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 5-methyl-1-[4-(o-phenetylcarbamoyl)phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OCC)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)N3C(=C(C=N3)C(=O)OCC)C

InChI

InChI=1S/C22H23N3O4/c1-4-28-20-9-7-6-8-19(20)24-21(26)16-10-12-17(13-11-16)25-15(3)18(14-23-25)22(27)29-5-2/h6-14H,4-5H2,1-3H3,(H,24,26)