methyl (3S)-3-(4-nitrophenyl)-1,2-dihydropyrazole-3-carboxylate

Systemtic Name: methyl (3S)-3-(4-nitrophenyl)-1,2-dihydropyrazole-3-carboxylate Openeye Name: methyl (3S)-3-(4-nitrophenyl)-1,2-dihydropyrazole-3-carboxylate CAS Name: (3S)-3-(4-nitrophenyl)-1,2-dihydropyrazole-3-carboxylic acid methyl ester IUPAC Name: methyl (3S)-3-(4-nitrophenyl)-1,2-dihydropyrazole-3-carboxylate Traditional Name: (3S)-3-(4-nitrophenyl)-3-pyrazoline-3-carboxylic acid methyl ester Formula: C11H11N3O4 MolecularWeight: 249.22274

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C=CNN1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC(=O)[C@]1(C=CNN1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H11N3O4/c1-18-10(15)11(6-7-12-13-11)8-2-4-9(5-3-8)14(16)17/h2-7,12-13H,1H3/t11-/m0/s1