3,5-bis(bromanyl)-N-ethyl-4-[3-(2-methyl-1-prop-2-enyl-pyrrolidin-1-ium-1-yl)propoxy]aniline bromide hydrobromide

Systemtic Name: 3,5-bis(bromanyl)-N-ethyl-4-[3-(2-methyl-1-prop-2-enyl-pyrrolidin-1-ium-1-yl)propoxy]aniline bromide hydrobromide Openeye Name: 4-[3-(1-allyl-2-methyl-pyrrolidin-1-ium-1-yl)propoxy]-3,5-dibromo-N-ethyl-aniline bromide hydrobromide CAS Name: 3,5-dibromo-N-ethyl-4-[3-(2-methyl-1-prop-2-enyl-1-pyrrolidin-1-iumyl)propoxy]aniline bromide hydrobromide IUPAC Name: 3,5-dibromo-N-ethyl-4-[3-(2-methyl-1-prop-2-enylpyrrolidin-1-ium-1-yl)propoxy]aniline bromide hydrobromide Traditional Name: [4-[3-(1-allyl-2-methyl-pyrrolidin-1-ium-1-yl)propoxy]-3,5-dibromo-phenyl]-ethyl-amine bromide hydrobromide Formula: C19H30Br4N2O MolecularWeight: 622.0703

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC(=C(C(=C1)Br)OCCC[N+]2(CCCC2C)CC=C)Br.Br.[Br-]

Isomeric SMILES

CCNC1=CC(=C(C(=C1)Br)OCCC[N+]2(CCCC2C)CC=C)Br.Br.[Br-]

InChI

InChI=1S/C19H29Br2N2O.2BrH/c1-4-9-23(10-6-8-15(23)3)11-7-12-24-19-17(20)13-16(22-5-2)14-18(19)21;;/h4,13-15,22H,1,5-12H2,2-3H3;2*1H/q+1;;/p-1