methyl 2-[4-chloranyl-5-(2-methoxy-2-oxidanylidene-ethyl)-2-nitro-phenyl]ethanoate

Systemtic Name: methyl 2-[4-chloranyl-5-(2-methoxy-2-oxidanylidene-ethyl)-2-nitro-phenyl]ethanoate Openeye Name: methyl 2-[4-chloro-5-(2-methoxy-2-oxo-ethyl)-2-nitro-phenyl]acetate CAS Name: 2-[4-chloro-5-(2-methoxy-2-oxoethyl)-2-nitrophenyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-chloro-5-(2-methoxy-2-oxoethyl)-2-nitrophenyl]acetate Traditional Name: 2-[4-chloro-5-(2-keto-2-methoxy-ethyl)-2-nitro-phenyl]acetic acid methyl ester Formula: C12H12ClNO6 MolecularWeight: 301.67978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClNO6/c1-19-11(15)4-7-3-8(5-12(16)20-2)10(14(17)18)6-9(7)13/h3,6H,4-5H2,1-2H3