2-[4-(2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)-2-bromanyl-6-ethoxy-phenoxy]-N-phenyl-ethanamide

Systemtic Name: 2-[4-(2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)-2-bromanyl-6-ethoxy-phenoxy]-N-phenyl-ethanamide Openeye Name: 2-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2-bromo-6-ethoxy-phenoxy]-N-phenyl-acetamide CAS Name: 2-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-4-yl)-2-bromo-6-ethoxyphenoxy]-N-phenylacetamide IUPAC Name: 2-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2-bromo-6-ethoxyphenoxy]-N-phenylacetamide Traditional Name: 2-[4-(2-amino-3-cyano-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromen-4-yl)-2-bromo-6-ethoxy-phenoxy]-N-phenyl-acetamide Formula: C28H28BrN3O5 MolecularWeight: 566.44302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)Br)OCC(=O)NC4=CC=CC=C4

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2C(=C(OC3=C2C(=O)CC(C3)(C)C)N)C#N)Br)OCC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C28H28BrN3O5/c1-4-35-21-11-16(10-19(29)26(21)36-15-23(34)32-17-8-6-5-7-9-17)24-18(14-30)27(31)37-22-13-28(2,3)12-20(33)25(22)24/h5-11,24H,4,12-13,15,31H2,1-3H3,(H,32,34)