[(3S,5S)-5-methylheptan-3-yl]-[(1S)-1-(2-methylphenyl)ethyl]azanium

Systemtic Name: [(3S,5S)-5-methylheptan-3-yl]-[(1S)-1-(2-methylphenyl)ethyl]azanium Openeye Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-[(1S)-1-(o-tolyl)ethyl]ammonium CAS Name: [(3S,5S)-5-methylheptan-3-yl]-[(1S)-1-(2-methylphenyl)ethyl]ammonium IUPAC Name: [(3S,5S)-5-methylheptan-3-yl]-[(1S)-1-(2-methylphenyl)ethyl]azanium Traditional Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-[(1S)-1-(o-tolyl)ethyl]ammonium Formula: C17H30N+ MolecularWeight: 248.4268

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)[NH2+]C(C)C1=CC=CC=C1C

Isomeric SMILES

CC[C@H](C)C[C@H](CC)[NH2+][C@@H](C)C1=CC=CC=C1C

InChI

InChI=1S/C17H29N/c1-6-13(3)12-16(7-2)18-15(5)17-11-9-8-10-14(17)4/h8-11,13,15-16,18H,6-7,12H2,1-5H3/p+1/t13-,15-,16-/m0/s1