methyl 2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyloxymethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethoxy]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]oxymethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]oxymethyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C18H17N5O7 MolecularWeight: 415.35688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)OCC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O7/c1-9-16(23(27)28)10(2)22(21-9)7-15(24)30-8-14-19-13-6-11(18(26)29-3)4-5-12(13)17(25)20-14/h4-6H,7-8H2,1-3H3,(H,19,20,25)