N,N-dibutyl-1-(phenylmethyl)-3,4-dihydro-2H-pyrrol-1-ium-5-amine bromide

Systemtic Name: N,N-dibutyl-1-(phenylmethyl)-3,4-dihydro-2H-pyrrol-1-ium-5-amine bromide Openeye Name: 1-benzyl-N,N-dibutyl-3,4-dihydro-2H-pyrrol-1-ium-5-amine bromide CAS Name: N,N-dibutyl-1-(phenylmethyl)-3,4-dihydro-2H-pyrrol-1-ium-5-amine bromide IUPAC Name: 1-benzyl-N,N-dibutyl-3,4-dihydro-2H-pyrrol-1-ium-5-amine bromide Traditional Name: (1-benzyl-1-pyrrolin-1-ium-2-yl)-dibutyl-amine bromide Formula: C19H31BrN2 MolecularWeight: 367.36684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=[N+](CCC1)CC2=CC=CC=C2.[Br-]

Isomeric SMILES

CCCCN(CCCC)C1=[N+](CCC1)CC2=CC=CC=C2.[Br-]

InChI

InChI=1S/C19H31N2.BrH/c1-3-5-14-20(15-6-4-2)19-13-10-16-21(19)17-18-11-8-7-9-12-18;/h7-9,11-12H,3-6,10,13-17H2,1-2H3;1H/q+1;/p-1