(2S)-1-(1-adamantylmethoxy)-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol

Systemtic Name: (2S)-1-(1-adamantylmethoxy)-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol Openeye Name: (2S)-1-(1-adamantylmethoxy)-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol CAS Name: (2S)-1-(1-adamantylmethoxy)-3-[4-(3-chlorophenyl)-1-piperazinyl]-2-propanol IUPAC Name: (2S)-1-(1-adamantylmethoxy)-3-[4-(3-chlorophenyl)piperazin-1-yl]propan-2-ol Traditional Name: (2S)-1-(1-adamantylmethoxy)-3-[4-(3-chlorophenyl)piperazino]propan-2-ol Formula: C24H35ClN2O2 MolecularWeight: 418.9999

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(COCC23CC4CC(C2)CC(C4)C3)O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1C[C@@H](COCC23CC4CC(C2)CC(C4)C3)O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C24H35ClN2O2/c25-21-2-1-3-22(11-21)27-6-4-26(5-7-27)15-23(28)16-29-17-24-12-18-8-19(13-24)10-20(9-18)14-24/h1-3,11,18-20,23,28H,4-10,12-17H2/t18?,19?,20?,23-,24?/m0/s1