methyl (5S)-5-methyl-3-(5-nitrofuran-2-yl)-1,4-dihydropyrazole-5-carboxylate

Systemtic Name: methyl (5S)-5-methyl-3-(5-nitrofuran-2-yl)-1,4-dihydropyrazole-5-carboxylate Openeye Name: methyl (5S)-5-methyl-3-(5-nitro-2-furyl)-1,4-dihydropyrazole-5-carboxylate CAS Name: (5S)-5-methyl-3-(5-nitro-2-furanyl)-1,4-dihydropyrazole-5-carboxylic acid methyl ester IUPAC Name: methyl (5S)-5-methyl-3-(5-nitrofuran-2-yl)-1,4-dihydropyrazole-5-carboxylate Traditional Name: (3S)-3-methyl-5-(5-nitro-2-furyl)-2-pyrazoline-3-carboxylic acid methyl ester Formula: C10H11N3O5 MolecularWeight: 253.21144

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=NN1)C2=CC=C(O2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

C[C@]1(CC(=NN1)C2=CC=C(O2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C10H11N3O5/c1-10(9(14)17-2)5-6(11-12-10)7-3-4-8(18-7)13(15)16/h3-4,12H,5H2,1-2H3/t10-/m0/s1