methyl 2-[4-[(7-methoxy-1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propanoate

Systemtic Name: methyl 2-[4-[(7-methoxy-1-oxidanidyl-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propanoate Openeye Name: methyl 2-[4-[(7-methoxy-1-oxido-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propanoate CAS Name: 2-[4-[(7-methoxy-1-oxido-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propanoic acid methyl ester IUPAC Name: methyl 2-[4-[(7-methoxy-1-oxido-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propanoate Traditional Name: 2-[4-[(7-methoxy-1-oxido-1,2,4-benzotriazin-1-ium-3-yl)oxy]phenoxy]propionic acid methyl ester Formula: C18H17N3O6 MolecularWeight: 371.34408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O6/c1-11(17(22)25-3)26-12-4-6-13(7-5-12)27-18-19-15-9-8-14(24-2)10-16(15)21(23)20-18/h4-11H,1-3H3