2-azanyl-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile

Systemtic Name: 2-azanyl-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-5-oxidanylidene-4,6,7,8-tetrahydrochromene-3-carbonitrile Openeye Name: 2-amino-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile CAS Name: 2-amino-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-5-oxo-4,6,7,8-tetrahydro-1-benzopyran-3-carbonitrile IUPAC Name: 2-amino-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-5-oxo-4,6,7,8-tetrahydrochromene-3-carbonitrile Traditional Name: 2-amino-4-(6,7-dimethoxy-1,3-benzodioxol-5-yl)-5-keto-4,6,7,8-tetrahydrochromene-3-carbonitrile Formula: C19H18N2O6 MolecularWeight: 370.35602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1C3C(=C(OC4=C3C(=O)CCC4)N)C#N)OCO2)OC

Isomeric SMILES

COC1=C(C2=C(C=C1C3C(=C(OC4=C3C(=O)CCC4)N)C#N)OCO2)OC

InChI

InChI=1S/C19H18N2O6/c1-23-16-9(6-13-17(18(16)24-2)26-8-25-13)14-10(7-20)19(21)27-12-5-3-4-11(22)15(12)14/h6,14H,3-5,8,21H2,1-2H3