N-[(1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl)methyl]butan-1-amine

Systemtic Name: N-[(1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl)methyl]butan-1-amine Openeye Name: N-[(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)methyl]butan-1-amine CAS Name: N-[(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)methyl]-1-butanamine IUPAC Name: N-[(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)methyl]butan-1-amine Traditional Name: butyl-[(1-oxidobenzofurazan-1-ium-5-yl)methyl]amine Formula: C11H15N3O2 MolecularWeight: 221.2557

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC1=CC2=NO[N+](=C2C=C1)[O-]

Isomeric SMILES

CCCCNCC1=CC2=NO[N+](=C2C=C1)[O-]

InChI

InChI=1S/C11H15N3O2/c1-2-3-6-12-8-9-4-5-11-10(7-9)13-16-14(11)15/h4-5,7,12H,2-3,6,8H2,1H3