[(3S,5S)-5-methylheptan-3-yl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]azanium

Systemtic Name: [(3S,5S)-5-methylheptan-3-yl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Openeye Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium CAS Name: [(3S,5S)-5-methylheptan-3-yl]-[2-methyl-2-(4-methyl-1-piperazin-4-iumyl)propyl]ammonium IUPAC Name: [(3S,5S)-5-methylheptan-3-yl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]azanium Traditional Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-[2-methyl-2-(4-methylpiperazin-4-ium-1-yl)propyl]ammonium Formula: C17H39N3+2 MolecularWeight: 285.51166

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)[NH2+]CC(C)(C)N1CC[NH+](CC1)C

Isomeric SMILES

CC[C@H](C)C[C@H](CC)[NH2+]CC(C)(C)N1CC[NH+](CC1)C

InChI

InChI=1S/C17H37N3/c1-7-15(3)13-16(8-2)18-14-17(4,5)20-11-9-19(6)10-12-20/h15-16,18H,7-14H2,1-6H3/p+2/t15-,16-/m0/s1