ethyl 6-azanyl-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-2-(chloromethyl)-5-cyano-4-(4-nitrophenyl)-4H-pyran-3-carboxylic acid ethyl ester Formula: C16H14ClN3O5 MolecularWeight: 363.75246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)[N+](=O)[O-])C#N)N)CCl

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)[N+](=O)[O-])C#N)N)CCl

InChI

InChI=1S/C16H14ClN3O5/c1-2-24-16(21)14-12(7-17)25-15(19)11(8-18)13(14)9-3-5-10(6-4-9)20(22)23/h3-6,13H,2,7,19H2,1H3