methyl 3-[2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]benzotriazole-5-carboxylate

Systemtic Name: methyl 3-[2-[(3-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethoxy]benzotriazole-5-carboxylate Openeye Name: methyl 3-[2-(3-fluoro-4-methyl-anilino)-2-oxo-ethoxy]benzotriazole-5-carboxylate CAS Name: 3-[2-(3-fluoro-4-methylanilino)-2-oxoethoxy]-5-benzotriazolecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-(3-fluoro-4-methylanilino)-2-oxoethoxy]benzotriazole-5-carboxylate Traditional Name: 3-[2-(3-fluoro-4-methyl-anilino)-2-keto-ethoxy]benzotriazole-5-carboxylic acid methyl ester Formula: C17H15FN4O4 MolecularWeight: 358.323803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CON2C3=C(C=CC(=C3)C(=O)OC)N=N2)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CON2C3=C(C=CC(=C3)C(=O)OC)N=N2)F

InChI

InChI=1S/C17H15FN4O4/c1-10-3-5-12(8-13(10)18)19-16(23)9-26-22-15-7-11(17(24)25-2)4-6-14(15)20-21-22/h3-8H,9H2,1-2H3,(H,19,23)