methyl 6-[(2-oxidanylidenechromen-3-yl)carbonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate

Systemtic Name: methyl 6-[(2-oxidanylidenechromen-3-yl)carbonylamino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: methyl 6-[(2-oxochromene-3-carbonyl)amino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 6-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid methyl ester IUPAC Name: methyl 6-[(2-oxochromene-3-carbonyl)amino]-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 6-[(2-ketochromene-3-carbonyl)amino]-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid methyl ester Formula: C20H15NO7 MolecularWeight: 381.3356

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1NC(=O)C3=CC4=CC=CC=C4OC3=O)OCCO2

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1NC(=O)C3=CC4=CC=CC=C4OC3=O)OCCO2

InChI

InChI=1S/C20H15NO7/c1-25-19(23)12-9-16-17(27-7-6-26-16)10-14(12)21-18(22)13-8-11-4-2-3-5-15(11)28-20(13)24/h2-5,8-10H,6-7H2,1H3,(H,21,22)