ethyl 2-[(E)-2-(3-chloranyl-4,5-dimethoxy-phenyl)ethenyl]-5-nitro-pyridine-3-carboxylate

Systemtic Name: ethyl 2-[(E)-2-(3-chloranyl-4,5-dimethoxy-phenyl)ethenyl]-5-nitro-pyridine-3-carboxylate Openeye Name: ethyl 2-[(E)-2-(3-chloro-4,5-dimethoxy-phenyl)vinyl]-5-nitro-pyridine-3-carboxylate CAS Name: 2-[(E)-2-(3-chloro-4,5-dimethoxyphenyl)ethenyl]-5-nitro-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(E)-2-(3-chloro-4,5-dimethoxyphenyl)ethenyl]-5-nitropyridine-3-carboxylate Traditional Name: 2-[(E)-2-(3-chloro-4,5-dimethoxy-phenyl)vinyl]-5-nitro-nicotinic acid ethyl ester Formula: C18H17ClN2O6 MolecularWeight: 392.79038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN=C1C=CC2=CC(=C(C(=C2)Cl)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CN=C1/C=C/C2=CC(=C(C(=C2)Cl)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClN2O6/c1-4-27-18(22)13-9-12(21(23)24)10-20-15(13)6-5-11-7-14(19)17(26-3)16(8-11)25-2/h5-10H,4H2,1-3H3/b6-5+