ethyl 5-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-phenyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-phenyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-phenyl-pyrazole-4-carboxylate CAS Name: 5-[[3-(5-methyl-4-nitro-1-pyrazolyl)-1-oxopropyl]amino]-1-phenyl-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[3-(5-methyl-4-nitropyrazol-1-yl)propanoylamino]-1-phenylpyrazole-4-carboxylate Traditional Name: 5-[3-(5-methyl-4-nitro-pyrazol-1-yl)propanoylamino]-1-phenyl-pyrazole-4-carboxylic acid ethyl ester Formula: C19H20N6O5 MolecularWeight: 412.3993

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CCN3C(=C(C=N3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=CC=C2)NC(=O)CCN3C(=C(C=N3)[N+](=O)[O-])C

InChI

InChI=1S/C19H20N6O5/c1-3-30-19(27)15-11-21-24(14-7-5-4-6-8-14)18(15)22-17(26)9-10-23-13(2)16(12-20-23)25(28)29/h4-8,11-12H,3,9-10H2,1-2H3,(H,22,26)