[3-(cyclohexylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 2-bromanyl-3,4,5-trimethoxy-benzoate

Systemtic Name: [3-(cyclohexylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 2-bromanyl-3,4,5-trimethoxy-benzoate Openeye Name: [3-(cyclohexylcarbamoyl)-2-oxo-chromen-7-yl] 2-bromo-3,4,5-trimethoxy-benzoate CAS Name: 2-bromo-3,4,5-trimethoxybenzoic acid [3-[(cyclohexylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(cyclohexylcarbamoyl)-2-oxochromen-7-yl] 2-bromo-3,4,5-trimethoxybenzoate Traditional Name: 2-bromo-3,4,5-trimethoxy-benzoic acid [3-(cyclohexylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C26H26BrNO8 MolecularWeight: 560.39054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NC4CCCCC4)Br)OC)OC

Isomeric SMILES

COC1=C(C(=C(C(=C1)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NC4CCCCC4)Br)OC)OC

InChI

InChI=1S/C26H26BrNO8/c1-32-20-13-17(21(27)23(34-3)22(20)33-2)25(30)35-16-10-9-14-11-18(26(31)36-19(14)12-16)24(29)28-15-7-5-4-6-8-15/h9-13,15H,4-8H2,1-3H3,(H,28,29)