ethyl 3-cyano-2-(3-nitrophenyl)-3,4-dihydropyrazole-5-carboxylate

Systemtic Name: ethyl 3-cyano-2-(3-nitrophenyl)-3,4-dihydropyrazole-5-carboxylate Openeye Name: ethyl 3-cyano-2-(3-nitrophenyl)-3,4-dihydropyrazole-5-carboxylate CAS Name: 3-cyano-2-(3-nitrophenyl)-3,4-dihydropyrazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-2-(3-nitrophenyl)-3,4-dihydropyrazole-5-carboxylate Traditional Name: 5-cyano-1-(3-nitrophenyl)-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C13H12N4O4 MolecularWeight: 288.25878

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H12N4O4/c1-2-21-13(18)12-7-11(8-14)16(15-12)9-4-3-5-10(6-9)17(19)20/h3-6,11H,2,7H2,1H3