2-azanyl-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-6-(hydroxymethyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carbonitrile

Systemtic Name: 2-azanyl-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-6-(hydroxymethyl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carbonitrile Openeye Name: 2-amino-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile CAS Name: 2-amino-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile IUPAC Name: 2-amino-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-6-(hydroxymethyl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile Traditional Name: 2-amino-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-8-keto-6-methylol-4H-pyrano[3,2-b]pyran-3-carbonitrile Formula: C19H16N2O8 MolecularWeight: 400.33894

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1C3C(=C(OC4=C3OC(=CC4=O)CO)N)C#N)OCO2)OC

Isomeric SMILES

COC1=C(C2=C(C=C1C3C(=C(OC4=C3OC(=CC4=O)CO)N)C#N)OCO2)OC

InChI

InChI=1S/C19H16N2O8/c1-24-14-9(4-12-16(18(14)25-2)27-7-26-12)13-10(5-20)19(21)29-15-11(23)3-8(6-22)28-17(13)15/h3-4,13,22H,6-7,21H2,1-2H3