(4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl (E)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enoate

Systemtic Name: (4-oxidanylidene-1,2,3-benzotriazin-3-yl)methyl (E)-3-(3-fluoranyl-4-methoxy-phenyl)prop-2-enoate Openeye Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl (E)-3-(3-fluoro-4-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(3-fluoro-4-methoxyphenyl)-2-propenoic acid (4-oxo-1,2,3-benzotriazin-3-yl)methyl ester IUPAC Name: (4-oxo-1,2,3-benzotriazin-3-yl)methyl (E)-3-(3-fluoro-4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(3-fluoro-4-methoxy-phenyl)acrylic acid (4-keto-1,2,3-benzotriazin-3-yl)methyl ester Formula: C18H14FN3O4 MolecularWeight: 355.319863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)OCN2C(=O)C3=CC=CC=C3N=N2)F

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)OCN2C(=O)C3=CC=CC=C3N=N2)F

InChI

InChI=1S/C18H14FN3O4/c1-25-16-8-6-12(10-14(16)19)7-9-17(23)26-11-22-18(24)13-4-2-3-5-15(13)20-21-22/h2-10H,11H2,1H3/b9-7+