[(2R)-2-methyl-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]pentyl]azanium

Systemtic Name: [(2R)-2-methyl-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]pentyl]azanium Openeye Name: [(2R)-2-(4-benzylpiperazin-4-ium-1-yl)-2-methyl-pentyl]ammonium CAS Name: [(2R)-2-methyl-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]pentyl]ammonium IUPAC Name: [(2R)-2-(4-benzylpiperazin-4-ium-1-yl)-2-methylpentyl]azanium Traditional Name: [(2R)-2-(4-benzylpiperazin-4-ium-1-yl)-2-methyl-pentyl]ammonium Formula: C17H31N3+2 MolecularWeight: 277.44814

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C[NH3+])N1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CCC[C@](C)(C[NH3+])N1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C17H29N3/c1-3-9-17(2,15-18)20-12-10-19(11-13-20)14-16-7-5-4-6-8-16/h4-8H,3,9-15,18H2,1-2H3/p+2/t17-/m1/s1