ethyl 6-azanyl-4-[5-bromanyl-2-[(3-nitrophenyl)methoxy]phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-4-[5-bromanyl-2-[(3-nitrophenyl)methoxy]phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-[5-bromo-2-[(3-nitrophenyl)methoxy]phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-[5-bromo-2-[(3-nitrophenyl)methoxy]phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-[5-bromo-2-[(3-nitrophenyl)methoxy]phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-[5-bromo-2-(3-nitrobenzyl)oxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C23H20BrN3O6 MolecularWeight: 514.3254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=C(C=CC(=C2)Br)OCC3=CC(=CC=C3)[N+](=O)[O-])C#N)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=C(C=CC(=C2)Br)OCC3=CC(=CC=C3)[N+](=O)[O-])C#N)N)C

InChI

InChI=1S/C23H20BrN3O6/c1-3-31-23(28)20-13(2)33-22(26)18(11-25)21(20)17-10-15(24)7-8-19(17)32-12-14-5-4-6-16(9-14)27(29)30/h4-10,21H,3,12,26H2,1-2H3