(3-azanylidene-1-oxidanidyl-7-phenoxy-1,2,4-benzotriazin-1-ium-4-yl) ethanoate

Systemtic Name: (3-azanylidene-1-oxidanidyl-7-phenoxy-1,2,4-benzotriazin-1-ium-4-yl) ethanoate Openeye Name: (3-imino-1-oxido-7-phenoxy-1,2,4-benzotriazin-1-ium-4-yl) acetate CAS Name: acetic acid (3-imino-1-oxido-7-phenoxy-1,2,4-benzotriazin-1-ium-4-yl) ester IUPAC Name: (3-imino-1-oxido-7-phenoxy-1,2,4-benzotriazin-1-ium-4-yl) acetate Traditional Name: acetic acid (3-imino-1-oxido-7-phenoxy-1,2,4-benzotriazin-1-ium-4-yl) ester Formula: C15H12N4O4 MolecularWeight: 312.28018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON1C2=C(C=C(C=C2)OC3=CC=CC=C3)[N+](=NC1=N)[O-]

Isomeric SMILES

CC(=O)ON1C2=C(C=C(C=C2)OC3=CC=CC=C3)[N+](=NC1=N)[O-]

InChI

InChI=1S/C15H12N4O4/c1-10(20)23-18-13-8-7-12(22-11-5-3-2-4-6-11)9-14(13)19(21)17-15(18)16/h2-9,16H,1H3