2-[6-azanyl-3,5-dicyano-4-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridin-2-yl]ethanoate

Systemtic Name: 2-[6-azanyl-3,5-dicyano-4-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridin-2-yl]ethanoate Openeye Name: 2-[6-amino-3,5-dicyano-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-pyridyl]acetate CAS Name: 2-[6-amino-3,5-dicyano-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-pyridinyl]acetate IUPAC Name: 2-[6-amino-3,5-dicyano-4-(2,3-dihydro-1,4-benzodioxin-6-yl)pyridin-2-yl]acetate Traditional Name: 2-[6-amino-3,5-dicyano-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-pyridyl]acetate Formula: C17H11N4O4- MolecularWeight: 335.29364

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=C(C(=NC(=C3C#N)N)CC(=O)[O-])C#N

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=C(C(=NC(=C3C#N)N)CC(=O)[O-])C#N

InChI

InChI=1S/C17H12N4O4/c18-7-10-12(6-15(22)23)21-17(20)11(8-19)16(10)9-1-2-13-14(5-9)25-4-3-24-13/h1-2,5H,3-4,6H2,(H2,20,21)(H,22,23)/p-1