(3-methylphenyl)methyl-[(2S)-pentan-2-yl]azanium

Systemtic Name: (3-methylphenyl)methyl-[(2S)-pentan-2-yl]azanium Openeye Name: [(1S)-1-methylbutyl]-(m-tolylmethyl)ammonium CAS Name: (3-methylphenyl)methyl-[(2S)-pentan-2-yl]ammonium IUPAC Name: (3-methylphenyl)methyl-[(2S)-pentan-2-yl]azanium Traditional Name: (3-methylbenzyl)-[(1S)-1-methylbutyl]ammonium Formula: C13H22N+ MolecularWeight: 192.32048

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H21N/c1-4-6-12(3)14-10-13-8-5-7-11(2)9-13/h5,7-9,12,14H,4,6,10H2,1-3H3/p+1/t12-/m0/s1