[(2S,3S,6S)-3-acetyloxy-6-(5,6-dimethylbenzotriazol-2-yl)oxan-2-yl]methyl ethanoate

Systemtic Name: [(2S,3S,6S)-3-acetyloxy-6-(5,6-dimethylbenzotriazol-2-yl)oxan-2-yl]methyl ethanoate Openeye Name: [(2S,3S,6S)-3-acetoxy-6-(5,6-dimethylbenzotriazol-2-yl)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2S,3S,6S)-3-acetyloxy-6-(5,6-dimethyl-2-benzotriazolyl)-2-oxanyl]methyl ester IUPAC Name: [(2S,3S,6S)-3-acetyloxy-6-(5,6-dimethylbenzotriazol-2-yl)oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2S,3S,6S)-3-acetoxy-6-(5,6-dimethylbenzotriazol-2-yl)tetrahydropyran-2-yl]methyl ester Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1C)C3CCC(C(O3)COC(=O)C)OC(=O)C

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1C)[C@@H]3CC[C@@H]([C@@H](O3)COC(=O)C)OC(=O)C

InChI

InChI=1S/C18H23N3O5/c1-10-7-14-15(8-11(10)2)20-21(19-14)18-6-5-16(25-13(4)23)17(26-18)9-24-12(3)22/h7-8,16-18H,5-6,9H2,1-4H3/t16-,17-,18-/m0/s1