methyl 2-[4-[(1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propanoate

Systemtic Name: methyl 2-[4-[(1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propanoate Openeye Name: methyl 2-[4-[(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propanoate CAS Name: 2-[4-[(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[4-[(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propanoate Traditional Name: 2-[4-[(1-oxido-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propionic acid methyl ester Formula: C17H15N3O5 MolecularWeight: 341.3181

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)OC1=CC=C(C=C1)OC2=NC3=CC=CC=C3[N+](=N2)[O-]

Isomeric SMILES

CC(C(=O)OC)OC1=CC=C(C=C1)OC2=NC3=CC=CC=C3[N+](=N2)[O-]

InChI

InChI=1S/C17H15N3O5/c1-11(16(21)23-2)24-12-7-9-13(10-8-12)25-17-18-14-5-3-4-6-15(14)20(22)19-17/h3-11H,1-2H3