2-[(3-azanyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium-7-yl)oxy]ethyl ethanoate

Systemtic Name: 2-[(3-azanyl-1-oxidanidyl-1,2,4-benzotriazin-1-ium-7-yl)oxy]ethyl ethanoate Openeye Name: 2-[(3-amino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]ethyl acetate CAS Name: acetic acid 2-[(3-amino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]ethyl ester IUPAC Name: 2-[(3-amino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]ethyl acetate Traditional Name: acetic acid 2-[(3-amino-1-oxido-1,2,4-benzotriazin-1-ium-7-yl)oxy]ethyl ester Formula: C11H12N4O4 MolecularWeight: 264.23738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCOC1=CC2=C(C=C1)N=C(N=[N+]2[O-])N

Isomeric SMILES

CC(=O)OCCOC1=CC2=C(C=C1)N=C(N=[N+]2[O-])N

InChI

InChI=1S/C11H12N4O4/c1-7(16)18-4-5-19-8-2-3-9-10(6-8)15(17)14-11(12)13-9/h2-3,6H,4-5H2,1H3,(H2,12,13,14)