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

Systemtic Name: 2-[2-(2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)-4-bromanyl-phenoxy]-N-(3-chloranyl-4-methyl-phenyl)ethanamide Openeye Name: 2-[2-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-4-bromo-phenoxy]-N-(3-chloro-4-methyl-phenyl)acetamide CAS Name: 2-[2-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-1-benzopyran-4-yl)-4-bromophenoxy]-N-(3-chloro-4-methylphenyl)acetamide IUPAC Name: 2-[2-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-4-bromophenoxy]-N-(3-chloro-4-methylphenyl)acetamide Traditional Name: 2-[2-(2-amino-3-cyano-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromen-4-yl)-4-bromo-phenoxy]-N-(3-chloro-4-methyl-phenyl)acetamide Formula: C27H25BrClN3O4 MolecularWeight: 570.8621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2)Br)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC2=C(C=C(C=C2)Br)C3C(=C(OC4=C3C(=O)CC(C4)(C)C)N)C#N)Cl

InChI

InChI=1S/C27H25BrClN3O4/c1-14-4-6-16(9-19(14)29)32-23(34)13-35-21-7-5-15(28)8-17(21)24-18(12-30)26(31)36-22-11-27(2,3)10-20(33)25(22)24/h4-9,24H,10-11,13,31H2,1-3H3,(H,32,34)