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

Systemtic Name: ethyl 2-[4-[(2-chloranylethanoylamino)carbamoyl]phenyl]-3-(2-hydroxyphenyl)-5-oxidanylidene-1H-pyrazole-4-carboxylate Openeye Name: ethyl 2-[4-[[(2-chloroacetyl)amino]carbamoyl]phenyl]-3-(2-hydroxyphenyl)-5-oxo-1H-pyrazole-4-carboxylate CAS Name: 2-[4-[[(2-chloro-1-oxoethyl)hydrazo]-oxomethyl]phenyl]-3-(2-hydroxyphenyl)-5-oxo-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-[[(2-chloroacetyl)amino]carbamoyl]phenyl]-3-(2-hydroxyphenyl)-5-oxo-1H-pyrazole-4-carboxylate Traditional Name: 1-[4-[[(2-chloroacetyl)amino]carbamoyl]phenyl]-5-(2-hydroxyphenyl)-3-keto-3-pyrazoline-4-carboxylic acid ethyl ester Formula: C21H19ClN4O6 MolecularWeight: 458.85176

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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=C3O

Isomeric SMILES

CCOC(=O)C1=C(N(NC1=O)C2=CC=C(C=C2)C(=O)NNC(=O)CCl)C3=CC=CC=C3O

InChI

InChI=1S/C21H19ClN4O6/c1-2-32-21(31)17-18(14-5-3-4-6-15(14)27)26(25-20(17)30)13-9-7-12(8-10-13)19(29)24-23-16(28)11-22/h3-10,27H,2,11H2,1H3,(H,23,28)(H,24,29)(H,25,30)