ethyl 2-[(E)-2-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)ethenyl]-5-nitro-pyridine-3-carboxylate

Systemtic Name: ethyl 2-[(E)-2-(3-chloranyl-5-methoxy-4-propan-2-yloxy-phenyl)ethenyl]-5-nitro-pyridine-3-carboxylate Openeye Name: ethyl 2-[(E)-2-(3-chloro-4-isopropoxy-5-methoxy-phenyl)vinyl]-5-nitro-pyridine-3-carboxylate CAS Name: 2-[(E)-2-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)ethenyl]-5-nitro-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(E)-2-(3-chloro-5-methoxy-4-propan-2-yloxyphenyl)ethenyl]-5-nitropyridine-3-carboxylate Traditional Name: 2-[(E)-2-(3-chloro-4-isopropoxy-5-methoxy-phenyl)vinyl]-5-nitro-nicotinic acid ethyl ester Formula: C20H21ClN2O6 MolecularWeight: 420.84354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21ClN2O6/c1-5-28-20(24)15-10-14(23(25)26)11-22-17(15)7-6-13-8-16(21)19(29-12(2)3)18(9-13)27-4/h6-12H,5H2,1-4H3/b7-6+