bis(azanyl)methylidene-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]azanium

Systemtic Name: bis(azanyl)methylidene-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]azanium Openeye Name: diaminomethylene-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]ammonium CAS Name: diaminomethylidene-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]ammonium IUPAC Name: diaminomethylidene-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]azanium Traditional Name: diaminomethylene-[(Z)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethylideneamino]ammonium Formula: C12H17N4O2+ MolecularWeight: 249.28898

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N[NH+]=C(N)N)C1=CC2=C(C=C1)OCCCO2

Isomeric SMILES

C/C(=N/[NH+]=C(N)N)/C1=CC2=C(C=C1)OCCCO2

InChI

InChI=1S/C12H16N4O2/c1-8(15-16-12(13)14)9-3-4-10-11(7-9)18-6-2-5-17-10/h3-4,7H,2,5-6H2,1H3,(H4,13,14,16)/p+1/b15-8-