methyl 5-[[4-(benzotriazol-1-ylmethyl)phenyl]carbonyloxymethyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[4-(benzotriazol-1-ylmethyl)phenyl]carbonyloxymethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[4-(benzotriazol-1-ylmethyl)benzoyl]oxymethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[4-(1-benzotriazolylmethyl)phenyl]-oxomethoxy]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-(benzotriazol-1-ylmethyl)benzoyl]oxymethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[4-(benzotriazol-1-ylmethyl)benzoyl]oxymethyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C22H19N3O5 MolecularWeight: 405.40336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)COC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)COC(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)C(=O)OC

InChI

InChI=1S/C22H19N3O5/c1-14-18(22(27)28-2)11-17(30-14)13-29-21(26)16-9-7-15(8-10-16)12-25-20-6-4-3-5-19(20)23-24-25/h3-11H,12-13H2,1-2H3