(2S)-1-(1-adamantyloxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol

Systemtic Name: (2S)-1-(1-adamantyloxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Openeye Name: (2S)-1-(1-adamantyloxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol CAS Name: (2S)-1-(1-adamantyloxy)-3-(4-ethyl-1-piperazin-4-iumyl)-2-propanol IUPAC Name: (2S)-1-(1-adamantyloxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Traditional Name: (2S)-1-(1-adamantyloxy)-3-(4-ethylpiperazin-4-ium-1-yl)propan-2-ol Formula: C19H35N2O2+ MolecularWeight: 323.4934

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC(COC23CC4CC(C2)CC(C4)C3)O

Isomeric SMILES

CC[NH+]1CCN(CC1)C[C@@H](COC23CC4CC(C2)CC(C4)C3)O

InChI

InChI=1S/C19H34N2O2/c1-2-20-3-5-21(6-4-20)13-18(22)14-23-19-10-15-7-16(11-19)9-17(8-15)12-19/h15-18,22H,2-14H2,1H3/p+1/t15?,16?,17?,18-,19?/m0/s1