1-butoxy-3-[1-(phenylmethyl)pyrrolidin-1-ium-1-yl]propan-2-ol

Systemtic Name: 1-butoxy-3-[1-(phenylmethyl)pyrrolidin-1-ium-1-yl]propan-2-ol Openeye Name: 1-(1-benzylpyrrolidin-1-ium-1-yl)-3-butoxy-propan-2-ol CAS Name: 1-butoxy-3-[1-(phenylmethyl)-1-pyrrolidin-1-iumyl]-2-propanol IUPAC Name: 1-(1-benzylpyrrolidin-1-ium-1-yl)-3-butoxypropan-2-ol Traditional Name: 1-(1-benzylpyrrolidin-1-ium-1-yl)-3-butoxy-propan-2-ol Formula: C18H30NO2+ MolecularWeight: 292.4363

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(C[N+]1(CCCC1)CC2=CC=CC=C2)O

Isomeric SMILES

CCCCOCC(C[N+]1(CCCC1)CC2=CC=CC=C2)O

InChI

InChI=1S/C18H30NO2/c1-2-3-13-21-16-18(20)15-19(11-7-8-12-19)14-17-9-5-4-6-10-17/h4-6,9-10,18,20H,2-3,7-8,11-16H2,1H3/q+1