[3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3,4,5-trimethoxybenzoate

Systemtic Name: [3-(2-methylpropylcarbamoyl)-2-oxidanylidene-chromen-7-yl] 3,4,5-trimethoxybenzoate Openeye Name: [3-(isobutylcarbamoyl)-2-oxo-chromen-7-yl] 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [3-[(2-methylpropylamino)-oxomethyl]-2-oxo-1-benzopyran-7-yl] ester IUPAC Name: [3-(2-methylpropylcarbamoyl)-2-oxochromen-7-yl] 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid [3-(isobutylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C24H25NO8 MolecularWeight: 455.4572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)OC1=O

Isomeric SMILES

CC(C)CNC(=O)C1=CC2=C(C=C(C=C2)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)OC1=O

InChI

InChI=1S/C24H25NO8/c1-13(2)12-25-22(26)17-8-14-6-7-16(11-18(14)33-24(17)28)32-23(27)15-9-19(29-3)21(31-5)20(10-15)30-4/h6-11,13H,12H2,1-5H3,(H,25,26)