(E)-N-butyl-3-(1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl)prop-2-enamide

Systemtic Name: (E)-N-butyl-3-(1-oxidanidyl-2,1,3-benzoxadiazol-1-ium-5-yl)prop-2-enamide Openeye Name: (E)-N-butyl-3-(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)prop-2-enamide CAS Name: (E)-N-butyl-3-(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)-2-propenamide IUPAC Name: (E)-N-butyl-3-(1-oxido-2,1,3-benzoxadiazol-1-ium-5-yl)prop-2-enamide Traditional Name: (E)-N-butyl-3-(1-oxidobenzofurazan-1-ium-5-yl)acrylamide Formula: C13H15N3O3 MolecularWeight: 261.2765

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C=CC1=CC2=NO[N+](=C2C=C1)[O-]

Isomeric SMILES

CCCCNC(=O)/C=C/C1=CC2=NO[N+](=C2C=C1)[O-]

InChI

InChI=1S/C13H15N3O3/c1-2-3-8-14-13(17)7-5-10-4-6-12-11(9-10)15-19-16(12)18/h4-7,9H,2-3,8H2,1H3,(H,14,17)/b7-5+