2-methyl-4-nitro-5-propyl-1,3-dihydropyrazole-3-carboxylic acid

Systemtic Name: 2-methyl-4-nitro-5-propyl-1,3-dihydropyrazole-3-carboxylic acid Openeye Name: 2-methyl-4-nitro-5-propyl-1,3-dihydropyrazole-3-carboxylic acid CAS Name: 2-methyl-4-nitro-5-propyl-1,3-dihydropyrazole-3-carboxylic acid IUPAC Name: 2-methyl-4-nitro-5-propyl-1,3-dihydropyrazole-3-carboxylic acid Traditional Name: 2-methyl-4-nitro-5-propyl-3-pyrazoline-3-carboxylic acid Formula: C8H13N3O4 MolecularWeight: 215.20652

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(N(N1)C)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CCCC1=C(C(N(N1)C)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H13N3O4/c1-3-4-5-6(11(14)15)7(8(12)13)10(2)9-5/h7,9H,3-4H2,1-2H3,(H,12,13)