[(2S)-2-azaniumyl-4-methyl-pentyl]-methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: [(2S)-2-azaniumyl-4-methyl-pentyl]-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [(2S)-2-azaniumyl-4-methyl-pentyl]-methyl-(p-tolylmethyl)ammonium CAS Name: [(2S)-2-ammonio-4-methylpentyl]-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [(2S)-2-azaniumyl-4-methylpentyl]-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [(2S)-2-ammonio-4-methyl-pentyl]-methyl-(4-methylbenzyl)ammonium Formula: C15H28N2+2 MolecularWeight: 236.39622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+](C)CC(CC(C)C)[NH3+]

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+](C)C[C@H](CC(C)C)[NH3+]

InChI

InChI=1S/C15H26N2/c1-12(2)9-15(16)11-17(4)10-14-7-5-13(3)6-8-14/h5-8,12,15H,9-11,16H2,1-4H3/p+2/t15-/m0/s1