2-azanyl-4-(6-bromanyl-1,3-benzodioxol-5-yl)-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carbonitrile

Systemtic Name: 2-azanyl-4-(6-bromanyl-1,3-benzodioxol-5-yl)-7-methyl-5-oxidanylidene-4H-pyrano[3,2-c]pyran-3-carbonitrile Openeye Name: 2-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile CAS Name: 2-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile IUPAC Name: 2-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-7-methyl-5-oxo-4H-pyrano[3,2-c]pyran-3-carbonitrile Traditional Name: 2-amino-4-(6-bromo-1,3-benzodioxol-5-yl)-5-keto-7-methyl-4H-pyrano[3,2-c]pyran-3-carbonitrile Formula: C17H11BrN2O5 MolecularWeight: 403.18364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC4=C(C=C3Br)OCO4)C(=O)O1

Isomeric SMILES

CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC4=C(C=C3Br)OCO4)C(=O)O1

InChI

InChI=1S/C17H11BrN2O5/c1-7-2-13-15(17(21)24-7)14(9(5-19)16(20)25-13)8-3-11-12(4-10(8)18)23-6-22-11/h2-4,14H,6,20H2,1H3