ethyl-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]azanium

Systemtic Name: ethyl-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]azanium Openeye Name: ethyl-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]ammonium CAS Name: ethyl-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-[[1-(1-methyl-4-piperidin-1-iumyl)-4-piperidin-1-iumyl]methyl]ammonium IUPAC Name: ethyl-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]azanium Traditional Name: ethyl-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]ammonium Formula: C21H42N5+3 MolecularWeight: 364.59168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C[NH+](CC)CC2CC[NH+](CC2)C3CC[NH+](CC3)C

Isomeric SMILES

CCN1C=C(C(=N1)C)C[NH+](CC)CC2CC[NH+](CC2)C3CC[NH+](CC3)C

InChI

InChI=1S/C21H39N5/c1-5-24(16-20-17-26(6-2)22-18(20)3)15-19-7-13-25(14-8-19)21-9-11-23(4)12-10-21/h17,19,21H,5-16H2,1-4H3/p+3