(3-fluoranyl-4-methoxy-phenyl)methyl 4-(benzotriazol-1-ylmethyl)benzoate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 4-(benzotriazol-1-ylmethyl)benzoate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 4-(benzotriazol-1-ylmethyl)benzoate CAS Name: 4-(1-benzotriazolylmethyl)benzoic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 4-(benzotriazol-1-ylmethyl)benzoate Traditional Name: 4-(benzotriazol-1-ylmethyl)benzoic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C22H18FN3O3 MolecularWeight: 391.395023

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)F

InChI

InChI=1S/C22H18FN3O3/c1-28-21-11-8-16(12-18(21)23)14-29-22(27)17-9-6-15(7-10-17)13-26-20-5-3-2-4-19(20)24-25-26/h2-12H,13-14H2,1H3