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

Systemtic Name: ethyl 1-[4-[(5-chloranyl-2-methoxy-phenyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[(5-chloro-2-methoxy-phenyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[(5-chloro-2-methoxyanilino)-oxomethyl]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(5-chloro-2-methoxyphenyl)carbamoyl]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[4-[(5-chloro-2-methoxy-phenyl)carbamoyl]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C21H20ClN3O4 MolecularWeight: 413.8542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)Cl)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=C(C=CC(=C3)Cl)OC)C

InChI

InChI=1S/C21H20ClN3O4/c1-4-29-21(27)17-12-23-25(13(17)2)16-8-5-14(6-9-16)20(26)24-18-11-15(22)7-10-19(18)28-3/h5-12H,4H2,1-3H3,(H,24,26)