2-[1-(3-azanylpropyl)-4-methyl-piperazin-1-ium-1-yl]-4,5-dihydroimidazol-1-amine; 4-methylbenzenesulfonic acid

Systemtic Name: 2-[1-(3-azanylpropyl)-4-methyl-piperazin-1-ium-1-yl]-4,5-dihydroimidazol-1-amine; 4-methylbenzenesulfonic acid Openeye Name: 2-[1-(3-aminopropyl)-4-methyl-piperazin-1-ium-1-yl]-4,5-dihydroimidazol-1-amine; 4-methylbenzenesulfonic acid CAS Name: 2-[1-(3-aminopropyl)-4-methyl-1-piperazin-1-iumyl]-4,5-dihydroimidazol-1-amine; 4-methylbenzenesulfonic acid IUPAC Name: 2-[1-(3-aminopropyl)-4-methylpiperazin-1-ium-1-yl]-4,5-dihydroimidazol-1-amine; 4-methylbenzenesulfonic acid Traditional Name: 3-[1-(1-amino-2-imidazolin-2-yl)-4-methyl-piperazin-1-ium-1-yl]propylamine; tosylic acid Formula: C18H33N6O3S+ MolecularWeight: 413.55802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)O.CN1CC[N+](CC1)(CCCN)C2=NCCN2N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)O.CN1CC[N+](CC1)(CCCN)C2=NCCN2N

InChI

InChI=1S/C11H25N6.C7H8O3S/c1-15-6-9-17(10-7-15,8-2-3-12)11-14-4-5-16(11)13;1-6-2-4-7(5-3-6)11(8,9)10/h2-10,12-13H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;