methyl (E)-4-(4-chloranyl-2-nitro-phenyl)-2-oxidanylidene-but-3-enoate

Systemtic Name: methyl (E)-4-(4-chloranyl-2-nitro-phenyl)-2-oxidanylidene-but-3-enoate Openeye Name: methyl (E)-4-(4-chloro-2-nitro-phenyl)-2-oxo-but-3-enoate CAS Name: (E)-4-(4-chloro-2-nitrophenyl)-2-oxo-3-butenoic acid methyl ester IUPAC Name: methyl (E)-4-(4-chloro-2-nitrophenyl)-2-oxobut-3-enoate Traditional Name: (E)-4-(4-chloro-2-nitro-phenyl)-2-keto-but-3-enoic acid methyl ester Formula: C11H8ClNO5 MolecularWeight: 269.63792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8ClNO5/c1-18-11(15)10(14)5-3-7-2-4-8(12)6-9(7)13(16)17/h2-6H,1H3/b5-3+