(2S)-1-(1-adamantylmethylamino)-3-[(3,4-dimethoxyphenyl)methoxy]propan-2-ol

Systemtic Name: (2S)-1-(1-adamantylmethylamino)-3-[(3,4-dimethoxyphenyl)methoxy]propan-2-ol Openeye Name: (2S)-1-(1-adamantylmethylamino)-3-[(3,4-dimethoxyphenyl)methoxy]propan-2-ol CAS Name: (2S)-1-(1-adamantylmethylamino)-3-[(3,4-dimethoxyphenyl)methoxy]-2-propanol IUPAC Name: (2S)-1-(1-adamantylmethylamino)-3-[(3,4-dimethoxyphenyl)methoxy]propan-2-ol Traditional Name: (2S)-1-(1-adamantylmethylamino)-3-veratryloxy-propan-2-ol Formula: C23H35NO4 MolecularWeight: 389.5283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COCC(CNCC23CC4CC(C2)CC(C4)C3)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)COC[C@H](CNCC23CC4CC(C2)CC(C4)C3)O)OC

InChI

InChI=1S/C23H35NO4/c1-26-21-4-3-16(8-22(21)27-2)13-28-14-20(25)12-24-15-23-9-17-5-18(10-23)7-19(6-17)11-23/h3-4,8,17-20,24-25H,5-7,9-15H2,1-2H3/t17?,18?,19?,20-,23?/m0/s1