ethyl 2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-5-nitro-pyridine-3-carboxylate

Systemtic Name: ethyl 2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-5-nitro-pyridine-3-carboxylate Openeye Name: ethyl 2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)vinyl]-5-nitro-pyridine-3-carboxylate CAS Name: 2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-5-nitro-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)ethenyl]-5-nitropyridine-3-carboxylate Traditional Name: 2-[(E)-2-(5-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)vinyl]-5-nitro-nicotinic acid ethyl ester Formula: C19H18N2O7 MolecularWeight: 386.35542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN=C1C=CC2=CC3=C(C(=C2)OC)OCCO3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CN=C1/C=C/C2=CC3=C(C(=C2)OC)OCCO3)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O7/c1-3-26-19(22)14-10-13(21(23)24)11-20-15(14)5-4-12-8-16(25-2)18-17(9-12)27-6-7-28-18/h4-5,8-11H,3,6-7H2,1-2H3/b5-4+