methyl 2-(2,4-dinitrophenyl)sulfinylbuta-2,3-dienoate

Systemtic Name: methyl 2-(2,4-dinitrophenyl)sulfinylbuta-2,3-dienoate Openeye Name: methyl 2-(2,4-dinitrophenyl)sulfinylbuta-2,3-dienoate CAS Name: 2-(2,4-dinitrophenyl)sulfinylbuta-2,3-dienoic acid methyl ester IUPAC Name: methyl 2-(2,4-dinitrophenyl)sulfinylbuta-2,3-dienoate Traditional Name: 2-(2,4-dinitrophenyl)sulfinylbuta-2,3-dienoic acid methyl ester Formula: C11H8N2O7S MolecularWeight: 312.25542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8N2O7S/c1-3-9(11(14)20-2)21(19)10-5-4-7(12(15)16)6-8(10)13(17)18/h4-6H,1H2,2H3