methyl 4-[2-(benzotriazol-1-ylmethyl)-3-ethanoyl-2H-1,3,4-oxadiazol-5-yl]benzoate

Systemtic Name: methyl 4-[2-(benzotriazol-1-ylmethyl)-3-ethanoyl-2H-1,3,4-oxadiazol-5-yl]benzoate Openeye Name: methyl 4-[3-acetyl-2-(benzotriazol-1-ylmethyl)-2H-1,3,4-oxadiazol-5-yl]benzoate CAS Name: 4-[3-acetyl-2-(1-benzotriazolylmethyl)-2H-1,3,4-oxadiazol-5-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-acetyl-2-(benzotriazol-1-ylmethyl)-2H-1,3,4-oxadiazol-5-yl]benzoate Traditional Name: 4-[3-acetyl-2-(benzotriazol-1-ylmethyl)-2H-1,3,4-oxadiazol-5-yl]benzoic acid methyl ester Formula: C19H17N5O4 MolecularWeight: 379.36938

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(OC(=N1)C2=CC=C(C=C2)C(=O)OC)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CC(=O)N1C(OC(=N1)C2=CC=C(C=C2)C(=O)OC)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C19H17N5O4/c1-12(25)24-17(11-23-16-6-4-3-5-15(16)20-22-23)28-18(21-24)13-7-9-14(10-8-13)19(26)27-2/h3-10,17H,11H2,1-2H3