(2S)-1-(6-bromanylnaphthalen-2-yl)oxy-3-pyrrolidin-1-ium-1-yl-propan-2-ol

Systemtic Name: (2S)-1-(6-bromanylnaphthalen-2-yl)oxy-3-pyrrolidin-1-ium-1-yl-propan-2-ol Openeye Name: (2S)-1-[(6-bromo-2-naphthyl)oxy]-3-pyrrolidin-1-ium-1-yl-propan-2-ol CAS Name: (2S)-1-[(6-bromo-2-naphthalenyl)oxy]-3-(1-pyrrolidin-1-iumyl)-2-propanol IUPAC Name: (2S)-1-(6-bromonaphthalen-2-yl)oxy-3-pyrrolidin-1-ium-1-ylpropan-2-ol Traditional Name: (2S)-1-(6-bromo-2-naphthoxy)-3-pyrrolidin-1-ium-1-yl-propan-2-ol Formula: C17H21BrNO2+ MolecularWeight: 351.25814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(COC2=CC3=C(C=C2)C=C(C=C3)Br)O

Isomeric SMILES

C1CC[NH+](C1)C[C@@H](COC2=CC3=C(C=C2)C=C(C=C3)Br)O

InChI

InChI=1S/C17H20BrNO2/c18-15-5-3-14-10-17(6-4-13(14)9-15)21-12-16(20)11-19-7-1-2-8-19/h3-6,9-10,16,20H,1-2,7-8,11-12H2/p+1/t16-/m0/s1