5-methyl-1,2-oxazole-4-carbonyl chloride; nitrobenzene

Systemtic Name: 5-methyl-1,2-oxazole-4-carbonyl chloride; nitrobenzene Openeye Name: 5-methylisoxazole-4-carbonyl chloride; nitrobenzene CAS Name: 5-methyl-4-isoxazolecarbonyl chloride; nitrobenzene IUPAC Name: 5-methyl-1,2-oxazole-4-carbonyl chloride; nitrobenzene Traditional Name: 5-methylisoxazole-4-carbonyl chloride; nitrobenzene Formula: C11H9ClN2O4 MolecularWeight: 268.65316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NO1)C(=O)Cl.C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NO1)C(=O)Cl.C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C6H5NO2.C5H4ClNO2/c8-7(9)6-4-2-1-3-5-6;1-3-4(5(6)8)2-7-9-3/h1-5H;2H,1H3