[2-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-1-ium-3-yl]methyl-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]azanium

Systemtic Name: [2-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-1-ium-3-yl]methyl-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]azanium Openeye Name: [2-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-1-ium-3-yl]methyl-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]ammonium CAS Name: [2-(4-methyl-1,4-diazepan-4-ium-1-yl)-3-pyridin-1-iumyl]methyl-[(3-methyl-1-propyl-4-pyrazolyl)methyl]ammonium IUPAC Name: [2-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-1-ium-3-yl]methyl-[(3-methyl-1-propylpyrazol-4-yl)methyl]azanium Traditional Name: [2-(4-methyl-1,4-diazepan-4-ium-1-yl)pyridin-1-ium-3-yl]methyl-[(3-methyl-1-propyl-pyrazol-4-yl)methyl]ammonium Formula: C20H35N6+3 MolecularWeight: 359.5321

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C(=N1)C)C[NH2+]CC2=C([NH+]=CC=C2)N3CCC[NH+](CC3)C

Isomeric SMILES

CCCN1C=C(C(=N1)C)C[NH2+]CC2=C([NH+]=CC=C2)N3CCC[NH+](CC3)C

InChI

InChI=1S/C20H32N6/c1-4-9-26-16-19(17(2)23-26)15-21-14-18-7-5-8-22-20(18)25-11-6-10-24(3)12-13-25/h5,7-8,16,21H,4,6,9-15H2,1-3H3/p+3