methyl 2,2-dinitro-3-phenyl-propanoate

Systemtic Name: methyl 2,2-dinitro-3-phenyl-propanoate Openeye Name: methyl 2,2-dinitro-3-phenyl-propanoate CAS Name: 2,2-dinitro-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2,2-dinitro-3-phenylpropanoate Traditional Name: 2,2-dinitro-3-phenyl-propionic acid methyl ester Formula: C10H10N2O6 MolecularWeight: 254.1962

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)([N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)([N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C10H10N2O6/c1-18-9(13)10(11(14)15,12(16)17)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3