[(2S)-heptan-2-yl]-[(4-methylphenyl)methyl]azanium

Systemtic Name: [(2S)-heptan-2-yl]-[(4-methylphenyl)methyl]azanium Openeye Name: [(1S)-1-methylhexyl]-(p-tolylmethyl)ammonium CAS Name: [(2S)-heptan-2-yl]-[(4-methylphenyl)methyl]ammonium IUPAC Name: [(2S)-heptan-2-yl]-[(4-methylphenyl)methyl]azanium Traditional Name: (4-methylbenzyl)-[(1S)-1-methylhexyl]ammonium Formula: C15H26N+ MolecularWeight: 220.37364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[NH2+]CC1=CC=C(C=C1)C

Isomeric SMILES

CCCCC[C@H](C)[NH2+]CC1=CC=C(C=C1)C

InChI

InChI=1S/C15H25N/c1-4-5-6-7-14(3)16-12-15-10-8-13(2)9-11-15/h8-11,14,16H,4-7,12H2,1-3H3/p+1/t14-/m0/s1