(5-methylfuran-2-yl)methyl-[(2S)-6-methylheptan-2-yl]azanium

Systemtic Name: (5-methylfuran-2-yl)methyl-[(2S)-6-methylheptan-2-yl]azanium Openeye Name: [(1S)-1,5-dimethylhexyl]-[(5-methyl-2-furyl)methyl]ammonium CAS Name: (5-methyl-2-furanyl)methyl-[(2S)-6-methylheptan-2-yl]ammonium IUPAC Name: (5-methylfuran-2-yl)methyl-[(2S)-6-methylheptan-2-yl]azanium Traditional Name: [(1S)-1,5-dimethylhexyl]-[(5-methyl-2-furyl)methyl]ammonium Formula: C14H26NO+ MolecularWeight: 224.36234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH2+]C(C)CCCC(C)C

Isomeric SMILES

CC1=CC=C(O1)C[NH2+][C@@H](C)CCCC(C)C

InChI

InChI=1S/C14H25NO/c1-11(2)6-5-7-12(3)15-10-14-9-8-13(4)16-14/h8-9,11-12,15H,5-7,10H2,1-4H3/p+1/t12-/m0/s1