methyl 6-(1,3-benzodioxol-5-yl)-4-[(2-methoxyphenyl)amino]-2-oxidanylidene-pyran-3-carboxylate

Systemtic Name: methyl 6-(1,3-benzodioxol-5-yl)-4-[(2-methoxyphenyl)amino]-2-oxidanylidene-pyran-3-carboxylate Openeye Name: methyl 6-(1,3-benzodioxol-5-yl)-4-(2-methoxyanilino)-2-oxo-pyran-3-carboxylate CAS Name: 6-(1,3-benzodioxol-5-yl)-4-(2-methoxyanilino)-2-oxo-3-pyrancarboxylic acid methyl ester IUPAC Name: methyl 6-(1,3-benzodioxol-5-yl)-4-(2-methoxyanilino)-2-oxopyran-3-carboxylate Traditional Name: 6-(1,3-benzodioxol-5-yl)-2-keto-4-(o-anisidino)pyran-3-carboxylic acid methyl ester Formula: C21H17NO7 MolecularWeight: 395.36218

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=C(C(=O)OC(=C2)C3=CC4=C(C=C3)OCO4)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1NC2=C(C(=O)OC(=C2)C3=CC4=C(C=C3)OCO4)C(=O)OC

InChI

InChI=1S/C21H17NO7/c1-25-15-6-4-3-5-13(15)22-14-10-17(29-21(24)19(14)20(23)26-2)12-7-8-16-18(9-12)28-11-27-16/h3-10,22H,11H2,1-2H3