prop-2-ynyl N-(2,5-dimethyl-4-nitro-pyrazol-3-yl)carbamate

Systemtic Name: prop-2-ynyl N-(2,5-dimethyl-4-nitro-pyrazol-3-yl)carbamate Openeye Name: prop-2-ynyl N-(2,5-dimethyl-4-nitro-pyrazol-3-yl)carbamate CAS Name: N-(2,5-dimethyl-4-nitro-3-pyrazolyl)carbamic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl N-(2,5-dimethyl-4-nitropyrazol-3-yl)carbamate Traditional Name: N-(2,5-dimethyl-4-nitro-pyrazol-3-yl)carbamic acid propargyl ester Formula: C9H10N4O4 MolecularWeight: 238.2001

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])NC(=O)OCC#C)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])NC(=O)OCC#C)C

InChI

InChI=1S/C9H10N4O4/c1-4-5-17-9(14)10-8-7(13(15)16)6(2)11-12(8)3/h1H,5H2,2-3H3,(H,10,14)