ethyl 4-azanyl-2-(4-nitrophenyl)-5-(1H-pyrrol-2-ylcarbonyl)pyrazole-3-carboxylate

Systemtic Name: ethyl 4-azanyl-2-(4-nitrophenyl)-5-(1H-pyrrol-2-ylcarbonyl)pyrazole-3-carboxylate Openeye Name: ethyl 4-amino-2-(4-nitrophenyl)-5-(1H-pyrrole-2-carbonyl)pyrazole-3-carboxylate CAS Name: 4-amino-2-(4-nitrophenyl)-5-[oxo(1H-pyrrol-2-yl)methyl]-3-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-(4-nitrophenyl)-5-(1H-pyrrole-2-carbonyl)pyrazole-3-carboxylate Traditional Name: 4-amino-2-(4-nitrophenyl)-5-(1H-pyrrole-2-carbonyl)pyrazole-3-carboxylic acid ethyl ester Formula: C17H15N5O5 MolecularWeight: 369.3315

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CN3)N

Isomeric SMILES

CCOC(=O)C1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CN3)N

InChI

InChI=1S/C17H15N5O5/c1-2-27-17(24)15-13(18)14(16(23)12-4-3-9-19-12)20-21(15)10-5-7-11(8-6-10)22(25)26/h3-9,19H,2,18H2,1H3