methyl (E)-6-(4-chloranyl-2-nitro-phenyl)hex-5-enoate

Systemtic Name: methyl (E)-6-(4-chloranyl-2-nitro-phenyl)hex-5-enoate Openeye Name: methyl (E)-6-(4-chloro-2-nitro-phenyl)hex-5-enoate CAS Name: (E)-6-(4-chloro-2-nitrophenyl)-5-hexenoic acid methyl ester IUPAC Name: methyl (E)-6-(4-chloro-2-nitrophenyl)hex-5-enoate Traditional Name: (E)-6-(4-chloro-2-nitro-phenyl)hex-5-enoic acid methyl ester Formula: C13H14ClNO4 MolecularWeight: 283.70756

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14ClNO4/c1-19-13(16)6-4-2-3-5-10-7-8-11(14)9-12(10)15(17)18/h3,5,7-9H,2,4,6H2,1H3/b5-3+