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

Systemtic Name: 2-[4-(2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)-2-methoxy-phenoxy]-N-(4-bromanyl-2,6-dimethyl-phenyl)ethanamide Openeye Name: 2-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2-methoxy-phenoxy]-N-(4-bromo-2,6-dimethyl-phenyl)acetamide CAS Name: 2-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-4-yl)-2-methoxyphenoxy]-N-(4-bromo-2,6-dimethylphenyl)acetamide IUPAC Name: 2-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2-methoxyphenoxy]-N-(4-bromo-2,6-dimethylphenyl)acetamide Traditional Name: 2-[4-(2-amino-3-cyano-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromen-4-yl)-2-methoxy-phenoxy]-N-(4-bromo-2,6-dimethyl-phenyl)acetamide Formula: C29H30BrN3O5 MolecularWeight: 580.4696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)COC2=C(C=C(C=C2)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)OC)C)Br

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)COC2=C(C=C(C=C2)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)OC)C)Br

InChI

InChI=1S/C29H30BrN3O5/c1-15-8-18(30)9-16(2)27(15)33-24(35)14-37-21-7-6-17(10-22(21)36-5)25-19(13-31)28(32)38-23-12-29(3,4)11-20(34)26(23)25/h6-10,25H,11-12,14,32H2,1-5H3,(H,33,35)