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

Systemtic Name: [(3S,4R)-3-(dimethylaminomethyl)-4-(3-methoxyphenyl)oxan-4-yl] ethanoate Openeye Name: [(3S,4R)-3-(dimethylaminomethyl)-4-(3-methoxyphenyl)tetrahydropyran-4-yl] acetate CAS Name: acetic acid [(3S,4R)-3-(dimethylaminomethyl)-4-(3-methoxyphenyl)-4-oxanyl] ester IUPAC Name: [(3S,4R)-3-(dimethylaminomethyl)-4-(3-methoxyphenyl)oxan-4-yl] acetate Traditional Name: acetic acid [(3S,4R)-3-(dimethylaminomethyl)-4-(3-methoxyphenyl)tetrahydropyran-4-yl] ester Formula: C17H25NO4 MolecularWeight: 307.3847

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1(CCOCC1CN(C)C)C2=CC(=CC=C2)OC

Isomeric SMILES

CC(=O)O[C@@]1(CCOC[C@@H]1CN(C)C)C2=CC(=CC=C2)OC

InChI

InChI=1S/C17H25NO4/c1-13(19)22-17(14-6-5-7-16(10-14)20-4)8-9-21-12-15(17)11-18(2)3/h5-7,10,15H,8-9,11-12H2,1-4H3/t15-,17-/m0/s1