[2-oxidanylidene-3-(prop-2-enylcarbamoyl)chromen-7-yl] 3,4,5-triethoxybenzoate

Systemtic Name: [2-oxidanylidene-3-(prop-2-enylcarbamoyl)chromen-7-yl] 3,4,5-triethoxybenzoate Openeye Name: [3-(allylcarbamoyl)-2-oxo-chromen-7-yl] 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid [2-oxo-3-[oxo-(prop-2-enylamino)methyl]-1-benzopyran-7-yl] ester IUPAC Name: [2-oxo-3-(prop-2-enylcarbamoyl)chromen-7-yl] 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid [3-(allylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C26H27NO8 MolecularWeight: 481.49448

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC=C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OC2=CC3=C(C=C2)C=C(C(=O)O3)C(=O)NCC=C

InChI

InChI=1S/C26H27NO8/c1-5-11-27-24(28)19-12-16-9-10-18(15-20(16)35-26(19)30)34-25(29)17-13-21(31-6-2)23(33-8-4)22(14-17)32-7-3/h5,9-10,12-15H,1,6-8,11H2,2-4H3,(H,27,28)