(3-azanylidene-7-methyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium-4-yl) (E)-but-2-enoate

Systemtic Name: (3-azanylidene-7-methyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium-4-yl) (E)-but-2-enoate Openeye Name: (3-imino-7-methyl-1-oxido-1,2,4-benzotriazin-1-ium-4-yl) (E)-but-2-enoate CAS Name: (E)-2-butenoic acid (3-imino-7-methyl-1-oxido-1,2,4-benzotriazin-1-ium-4-yl) ester IUPAC Name: (3-imino-7-methyl-1-oxido-1,2,4-benzotriazin-1-ium-4-yl) (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid (3-imino-7-methyl-1-oxido-1,2,4-benzotriazin-1-ium-4-yl) ester Formula: C12H12N4O3 MolecularWeight: 260.24868

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)ON1C2=C(C=C(C=C2)C)[N+](=NC1=N)[O-]

Isomeric SMILES

C/C=C/C(=O)ON1C2=C(C=C(C=C2)C)[N+](=NC1=N)[O-]

InChI

InChI=1S/C12H12N4O3/c1-3-4-11(17)19-15-9-6-5-8(2)7-10(9)16(18)14-12(15)13/h3-7,13H,1-2H3/b4-3+,13-12?