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

Systemtic Name: 2-azanyl-6-(hydroxymethyl)-4-(6-nitro-1,3-benzodioxol-5-yl)-8-oxidanylidene-4H-pyrano[3,2-b]pyran-3-carbonitrile Openeye Name: 2-amino-6-(hydroxymethyl)-4-(6-nitro-1,3-benzodioxol-5-yl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile CAS Name: 2-amino-6-(hydroxymethyl)-4-(6-nitro-1,3-benzodioxol-5-yl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile IUPAC Name: 2-amino-6-(hydroxymethyl)-4-(6-nitro-1,3-benzodioxol-5-yl)-8-oxo-4H-pyrano[3,2-b]pyran-3-carbonitrile Traditional Name: 2-amino-8-keto-6-methylol-4-(6-nitro-1,3-benzodioxol-5-yl)-4H-pyrano[3,2-b]pyran-3-carbonitrile Formula: C17H11N3O8 MolecularWeight: 385.28454

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C3C(=C(OC4=C3OC(=CC4=O)CO)N)C#N)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)C3C(=C(OC4=C3OC(=CC4=O)CO)N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H11N3O8/c18-4-9-14(8-2-12-13(26-6-25-12)3-10(8)20(23)24)16-15(28-17(9)19)11(22)1-7(5-21)27-16/h1-3,14,21H,5-6,19H2