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

Systemtic Name: 2-[4-(2-azanyl-3-cyano-7,7-dimethyl-5-oxidanylidene-6,8-dihydro-4H-chromen-4-yl)-2-bromanyl-6-methoxy-phenoxy]-N-(4-bromophenyl)ethanamide Openeye Name: 2-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2-bromo-6-methoxy-phenoxy]-N-(4-bromophenyl)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-methoxyphenoxy]-N-(4-bromophenyl)acetamide IUPAC Name: 2-[4-(2-amino-3-cyano-7,7-dimethyl-5-oxo-6,8-dihydro-4H-chromen-4-yl)-2-bromo-6-methoxyphenoxy]-N-(4-bromophenyl)acetamide Traditional Name: 2-[4-(2-amino-3-cyano-5-keto-7,7-dimethyl-6,8-dihydro-4H-chromen-4-yl)-2-bromo-6-methoxy-phenoxy]-N-(4-bromophenyl)acetamide Formula: C27H25Br2N3O5 MolecularWeight: 631.3125

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C(=C3)Br)OCC(=O)NC4=CC=C(C=C4)Br)OC)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C(=C(O2)N)C#N)C3=CC(=C(C(=C3)Br)OCC(=O)NC4=CC=C(C=C4)Br)OC)C(=O)C1)C

InChI

InChI=1S/C27H25Br2N3O5/c1-27(2)10-19(33)24-21(11-27)37-26(31)17(12-30)23(24)14-8-18(29)25(20(9-14)35-3)36-13-22(34)32-16-6-4-15(28)5-7-16/h4-9,23H,10-11,13,31H2,1-3H3,(H,32,34)