3-(4-methylpiperazin-4-ium-1-yl)propyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]azanium

Systemtic Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]azanium Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]ammonium CAS Name: 3-(4-methyl-1-piperazin-4-iumyl)propyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]ammonium IUPAC Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]azanium Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)propyl-[(1S,5R)-3,3,5-trimethylcyclohexyl]ammonium Formula: C17H37N3+2 MolecularWeight: 283.49578

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)[NH2+]CCCN2CC[NH+](CC2)C

Isomeric SMILES

C[C@H]1C[C@@H](CC(C1)(C)C)[NH2+]CCCN2CC[NH+](CC2)C

InChI

InChI=1S/C17H35N3/c1-15-12-16(14-17(2,3)13-15)18-6-5-7-20-10-8-19(4)9-11-20/h15-16,18H,5-14H2,1-4H3/p+2/t15-,16-/m0/s1