7-decyl-1-oxidanylidene-7H-1,2,4-benzotriazin-1-ium-3-amine

Systemtic Name: 7-decyl-1-oxidanylidene-7H-1,2,4-benzotriazin-1-ium-3-amine Openeye Name: 7-decyl-1-oxo-7H-1,2,4-benzotriazin-1-ium-3-amine CAS Name: 7-decyl-1-oxo-7H-1,2,4-benzotriazin-1-ium-3-amine IUPAC Name: 7-decyl-1-oxo-7H-1,2,4-benzotriazin-1-ium-3-amine Traditional Name: (7-decyl-1-keto-7H-1,2,4-benzotriazin-1-ium-3-yl)amine Formula: C17H27N4O+ MolecularWeight: 303.42248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1C=CC2=NC(=N[N+](=O)C2=C1)N

Isomeric SMILES

CCCCCCCCCCC1C=CC2=NC(=N[N+](=O)C2=C1)N

InChI

InChI=1S/C17H27N4O/c1-2-3-4-5-6-7-8-9-10-14-11-12-15-16(13-14)21(22)20-17(18)19-15/h11-14H,2-10H2,1H3,(H2,18,20,22)/q+1