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

Systemtic Name: [2-oxidanylidene-3-(prop-2-enylcarbamoyl)chromen-7-yl] 3,4-dimethoxybenzoate Openeye Name: [3-(allylcarbamoyl)-2-oxo-chromen-7-yl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic 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-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [3-(allylcarbamoyl)-2-keto-chromen-7-yl] ester Formula: C22H19NO7 MolecularWeight: 409.38876

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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)NCC=C)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H19NO7/c1-4-9-23-20(24)16-10-13-5-7-15(12-18(13)30-22(16)26)29-21(25)14-6-8-17(27-2)19(11-14)28-3/h4-8,10-12H,1,9H2,2-3H3,(H,23,24)