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

Systemtic Name: ethyl 6-azanyl-4-[2-bromanyl-4-[(2-cyanophenyl)methoxy]-5-methoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-[2-bromo-4-[(2-cyanophenyl)methoxy]-5-methoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate CAS Name: 6-amino-4-[2-bromo-4-[(2-cyanophenyl)methoxy]-5-methoxyphenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-[2-bromo-4-[(2-cyanophenyl)methoxy]-5-methoxyphenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-[2-bromo-4-(2-cyanobenzyl)oxy-5-methoxy-phenyl]-5-cyano-2-methyl-4H-pyran-3-carboxylic acid ethyl ester Formula: C25H22BrN3O5 MolecularWeight: 524.36328

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2Br)OCC3=CC=CC=C3C#N)OC)C#N)N)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC(=C(C=C2Br)OCC3=CC=CC=C3C#N)OC)C#N)N)C

InChI

InChI=1S/C25H22BrN3O5/c1-4-32-25(30)22-14(2)34-24(29)18(12-28)23(22)17-9-20(31-3)21(10-19(17)26)33-13-16-8-6-5-7-15(16)11-27/h5-10,23H,4,13,29H2,1-3H3