(2S)-1-[4-(1-adamantyl)phenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-[4-(1-adamantyl)phenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-[4-(1-adamantyl)phenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-[4-(1-adamantyl)phenoxy]-3-(1-pyrrolidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-[4-(1-adamantyl)phenoxy]-3-pyrrolidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-[4-(1-adamantyl)phenoxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol Formula: C23H34NO2+ MolecularWeight: 356.52156

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)O

Isomeric SMILES

C1CC[NH+](C1)C[C@@H](COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)O

InChI

InChI=1S/C23H33NO2/c25-21(15-24-7-1-2-8-24)16-26-22-5-3-20(4-6-22)23-12-17-9-18(13-23)11-19(10-17)14-23/h3-6,17-19,21,25H,1-2,7-16H2/p+1/t17?,18?,19?,21-,23?/m0/s1