[(2S,6S)-6-(5,6-dimethylbenzotriazol-1-yl)oxan-2-yl]methyl ethanoate

Systemtic Name: [(2S,6S)-6-(5,6-dimethylbenzotriazol-1-yl)oxan-2-yl]methyl ethanoate Openeye Name: [(2S,6S)-6-(5,6-dimethylbenzotriazol-1-yl)tetrahydropyran-2-yl]methyl acetate CAS Name: acetic acid [(2S,6S)-6-(5,6-dimethyl-1-benzotriazolyl)-2-oxanyl]methyl ester IUPAC Name: [(2S,6S)-6-(5,6-dimethylbenzotriazol-1-yl)oxan-2-yl]methyl acetate Traditional Name: acetic acid [(2S,6S)-6-(5,6-dimethylbenzotriazol-1-yl)tetrahydropyran-2-yl]methyl ester Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(N=N2)C3CCCC(O3)COC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1C)N(N=N2)[C@@H]3CCC[C@H](O3)COC(=O)C

InChI

InChI=1S/C16H21N3O3/c1-10-7-14-15(8-11(10)2)19(18-17-14)16-6-4-5-13(22-16)9-21-12(3)20/h7-8,13,16H,4-6,9H2,1-3H3/t13-,16-/m0/s1