ethyl 5-azanyl-3-[(3-nitrophenyl)sulfonylamino]-1H-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-3-[(3-nitrophenyl)sulfonylamino]-1H-pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-3-[(3-nitrophenyl)sulfonylamino]-1H-pyrazole-4-carboxylate CAS Name: 5-amino-3-[(3-nitrophenyl)sulfonylamino]-1H-pyrazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-3-[(3-nitrophenyl)sulfonylamino]-1H-pyrazole-4-carboxylate Traditional Name: 5-amino-3-[(3-nitrophenyl)sulfonylamino]-1H-pyrazole-4-carboxylic acid ethyl ester Formula: C12H13N5O6S MolecularWeight: 355.32652

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NN=C1NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)C1=C(NN=C1NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])N

InChI

InChI=1S/C12H13N5O6S/c1-2-23-12(18)9-10(13)14-15-11(9)16-24(21,22)8-5-3-4-7(6-8)17(19)20/h3-6H,2H2,1H3,(H4,13,14,15,16)