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

Systemtic Name: ethyl 6-azanyl-4-(4-chloranyl-3-nitro-phenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-(4-chloro-3-nitro-phenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(4-chloro-3-nitrophenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-(4-chloro-3-nitrophenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(4-chloro-3-nitro-phenyl)-5-cyano-2-phenyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C21H16ClN3O5 MolecularWeight: 425.82184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C#N)N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C#N)N)C3=CC=CC=C3

InChI

InChI=1S/C21H16ClN3O5/c1-2-29-21(26)18-17(13-8-9-15(22)16(10-13)25(27)28)14(11-23)20(24)30-19(18)12-6-4-3-5-7-12/h3-10,17H,2,24H2,1H3