[(2S)-5-methylhexan-2-yl]-[(2,4,6-trimethylphenyl)methyl]azanium

Systemtic Name: [(2S)-5-methylhexan-2-yl]-[(2,4,6-trimethylphenyl)methyl]azanium Openeye Name: [(1S)-1,4-dimethylpentyl]-[(2,4,6-trimethylphenyl)methyl]ammonium CAS Name: [(2S)-5-methylhexan-2-yl]-[(2,4,6-trimethylphenyl)methyl]ammonium IUPAC Name: [(2S)-5-methylhexan-2-yl]-[(2,4,6-trimethylphenyl)methyl]azanium Traditional Name: [(1S)-1,4-dimethylpentyl]-(2,4,6-trimethylbenzyl)ammonium Formula: C17H30N+ MolecularWeight: 248.4268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H29N/c1-12(2)7-8-16(6)18-11-17-14(4)9-13(3)10-15(17)5/h9-10,12,16,18H,7-8,11H2,1-6H3/p+1/t16-/m0/s1