2-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-4,5-dimethyl-furan-3-carbonitrile

Systemtic Name: 2-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-4,5-dimethyl-furan-3-carbonitrile Openeye Name: 2-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-4,5-dimethyl-furan-3-carbonitrile CAS Name: 2-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-4,5-dimethyl-3-furancarbonitrile IUPAC Name: 2-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-4,5-dimethylfuran-3-carbonitrile Traditional Name: 2-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-4,5-dimethyl-3-furonitrile Formula: C15H11BrN2O3 MolecularWeight: 347.16344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=C1C#N)N=CC2=CC3=C(C=C2Br)OCO3)C

Isomeric SMILES

CC1=C(OC(=C1C#N)/N=C/C2=CC3=C(C=C2Br)OCO3)C

InChI

InChI=1S/C15H11BrN2O3/c1-8-9(2)21-15(11(8)5-17)18-6-10-3-13-14(4-12(10)16)20-7-19-13/h3-4,6H,7H2,1-2H3/b18-6+