ethyl 1-[4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]phenyl]-5-methyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 1-[4-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]phenyl]-5-methyl-pyrazole-4-carboxylate Openeye Name: ethyl 1-[4-[(4-chloro-3-nitro-phenyl)sulfonylamino]phenyl]-5-methyl-pyrazole-4-carboxylate CAS Name: 1-[4-[(4-chloro-3-nitrophenyl)sulfonylamino]phenyl]-5-methyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(4-chloro-3-nitrophenyl)sulfonylamino]phenyl]-5-methylpyrazole-4-carboxylate Traditional Name: 1-[4-[(4-chloro-3-nitro-phenyl)sulfonylamino]phenyl]-5-methyl-pyrazole-4-carboxylic acid ethyl ester Formula: C19H17ClN4O6S MolecularWeight: 464.87948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C19H17ClN4O6S/c1-3-30-19(25)16-11-21-23(12(16)2)14-6-4-13(5-7-14)22-31(28,29)15-8-9-17(20)18(10-15)24(26)27/h4-11,22H,3H2,1-2H3