ethyl 2-[4-[(2-chloranylethanoylamino)carbamoyl]phenyl]-3-(2-methoxyphenyl)-5-oxidanylidene-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 2-[4-[(2-chloranylethanoylamino)carbamoyl]phenyl]-3-(2-methoxyphenyl)-5-oxidanylidene-1H-pyrazole-4-carboxylate Openeye Name: ethyl 2-[4-[[(2-chloroacetyl)amino]carbamoyl]phenyl]-3-(2-methoxyphenyl)-5-oxo-1H-pyrazole-4-carboxylate CAS Name: 2-[4-[[(2-chloro-1-oxoethyl)hydrazo]-oxomethyl]phenyl]-3-(2-methoxyphenyl)-5-oxo-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-[[(2-chloroacetyl)amino]carbamoyl]phenyl]-3-(2-methoxyphenyl)-5-oxo-1H-pyrazole-4-carboxylate Traditional Name: 1-[4-[[(2-chloroacetyl)amino]carbamoyl]phenyl]-3-keto-5-(2-methoxyphenyl)-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C22H21ClN4O6 MolecularWeight: 472.87834

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(NC1=O)C2=CC=C(C=C2)C(=O)NNC(=O)CCl)C3=CC=CC=C3OC

Isomeric SMILES

CCOC(=O)C1=C(N(NC1=O)C2=CC=C(C=C2)C(=O)NNC(=O)CCl)C3=CC=CC=C3OC

InChI

InChI=1S/C22H21ClN4O6/c1-3-33-22(31)18-19(15-6-4-5-7-16(15)32-2)27(26-21(18)30)14-10-8-13(9-11-14)20(29)25-24-17(28)12-23/h4-11H,3,12H2,1-2H3,(H,24,28)(H,25,29)(H,26,30)