3-azanylidene-N'-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-4-oxidanyl-quinoxaline-2-carboximidamide

Systemtic Name: 3-azanylidene-N'-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-4-oxidanyl-quinoxaline-2-carboximidamide Openeye Name: N'-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-4-hydroxy-3-imino-quinoxaline-2-carboxamidine CAS Name: N'-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-4-hydroxy-3-imino-2-quinoxalinecarboximidamide IUPAC Name: N'-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-4-hydroxy-3-iminoquinoxaline-2-carboximidamide Traditional Name: N'-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-4-hydroxy-3-imino-quinoxaline-2-carboxamidine Formula: C17H13BrN6O3 MolecularWeight: 429.22752

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C=NN=C(C3=NC4=CC=CC=C4N(C3=N)O)N)Br

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)/C=N/N=C(/C3=NC4=CC=CC=C4N(C3=N)O)\N)Br

InChI

InChI=1S/C17H13BrN6O3/c18-10-6-14-13(26-8-27-14)5-9(10)7-21-23-16(19)15-17(20)24(25)12-4-2-1-3-11(12)22-15/h1-7,20,25H,8H2,(H2,19,23)/b20-17?,21-7+