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

Systemtic Name: (2S)-1-(1-adamantylmethoxy)-3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-ol Openeye Name: (2S)-1-(1-adamantylmethoxy)-3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-ol CAS Name: (2S)-1-(1-adamantylmethoxy)-3-[4-(2-methoxyphenyl)-1-piperazinyl]-2-propanol IUPAC Name: (2S)-1-(1-adamantylmethoxy)-3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-2-ol Traditional Name: (2S)-1-(1-adamantylmethoxy)-3-[4-(2-methoxyphenyl)piperazino]propan-2-ol Formula: C25H38N2O3 MolecularWeight: 414.58082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CC(COCC34CC5CC(C3)CC(C5)C4)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C[C@@H](COCC34CC5CC(C3)CC(C5)C4)O

InChI

InChI=1S/C25H38N2O3/c1-29-24-5-3-2-4-23(24)27-8-6-26(7-9-27)16-22(28)17-30-18-25-13-19-10-20(14-25)12-21(11-19)15-25/h2-5,19-22,28H,6-18H2,1H3/t19?,20?,21?,22-,25?/m0/s1