[3-[(3S,4R)-4-acetyloxy-3-(dimethylaminomethyl)oxan-4-yl]phenyl] ethanoate

Systemtic Name: [3-[(3S,4R)-4-acetyloxy-3-(dimethylaminomethyl)oxan-4-yl]phenyl] ethanoate Openeye Name: [3-[(3S,4R)-4-acetoxy-3-(dimethylaminomethyl)tetrahydropyran-4-yl]phenyl] acetate CAS Name: acetic acid [3-[(3S,4R)-4-acetyloxy-3-(dimethylaminomethyl)-4-oxanyl]phenyl] ester IUPAC Name: [3-[(3S,4R)-4-acetyloxy-3-(dimethylaminomethyl)oxan-4-yl]phenyl] acetate Traditional Name: acetic acid [3-[(3S,4R)-4-acetoxy-3-(dimethylaminomethyl)tetrahydropyran-4-yl]phenyl] ester Formula: C18H25NO5 MolecularWeight: 335.3948

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC(=C1)C2(CCOCC2CN(C)C)OC(=O)C

Isomeric SMILES

CC(=O)OC1=CC=CC(=C1)[C@]2(CCOC[C@@H]2CN(C)C)OC(=O)C

InChI

InChI=1S/C18H25NO5/c1-13(20)23-17-7-5-6-15(10-17)18(24-14(2)21)8-9-22-12-16(18)11-19(3)4/h5-7,10,16H,8-9,11-12H2,1-4H3/t16-,18-/m0/s1