ethyl 6-azanyl-4-(3-chloranyl-4-nitro-phenyl)-5-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-4-(3-chloranyl-4-nitro-phenyl)-5-cyano-2-(2-ethoxy-2-oxidanylidene-ethyl)-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-(3-chloro-4-nitro-phenyl)-5-cyano-2-(2-ethoxy-2-oxo-ethyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(3-chloro-4-nitrophenyl)-5-cyano-2-(2-ethoxy-2-oxoethyl)-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-(3-chloro-4-nitrophenyl)-5-cyano-2-(2-ethoxy-2-oxoethyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(3-chloro-4-nitro-phenyl)-5-cyano-2-(2-ethoxy-2-keto-ethyl)-4H-pyran-3-carboxylic acid ethyl ester Formula: C19H18ClN3O7 MolecularWeight: 435.81512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(C(C(=C(O1)N)C#N)C2=CC(=C(C=C2)[N+](=O)[O-])Cl)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC1=C(C(C(=C(O1)N)C#N)C2=CC(=C(C=C2)[N+](=O)[O-])Cl)C(=O)OCC

InChI

InChI=1S/C19H18ClN3O7/c1-3-28-15(24)8-14-17(19(25)29-4-2)16(11(9-21)18(22)30-14)10-5-6-13(23(26)27)12(20)7-10/h5-7,16H,3-4,8,22H2,1-2H3