[(2S,3S)-2-azaniumyl-3-methyl-pentyl]-methyl-[(4-methylphenyl)methyl]azanium

Systemtic Name: [(2S,3S)-2-azaniumyl-3-methyl-pentyl]-methyl-[(4-methylphenyl)methyl]azanium Openeye Name: [(2S,3S)-2-azaniumyl-3-methyl-pentyl]-methyl-(p-tolylmethyl)ammonium CAS Name: [(2S,3S)-2-ammonio-3-methylpentyl]-methyl-[(4-methylphenyl)methyl]ammonium IUPAC Name: [(2S,3S)-2-azaniumyl-3-methylpentyl]-methyl-[(4-methylphenyl)methyl]azanium Traditional Name: [(2S,3S)-2-ammonio-3-methyl-pentyl]-methyl-(4-methylbenzyl)ammonium Formula: C15H28N2+2 MolecularWeight: 236.39622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H26N2/c1-5-13(3)15(16)11-17(4)10-14-8-6-12(2)7-9-14/h6-9,13,15H,5,10-11,16H2,1-4H3/p+2/t13-,15+/m0/s1