[(3S,5S)-5-methylheptan-3-yl]-(4-oxidanylcyclohexyl)azanium

Systemtic Name: [(3S,5S)-5-methylheptan-3-yl]-(4-oxidanylcyclohexyl)azanium Openeye Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-(4-hydroxycyclohexyl)ammonium CAS Name: (4-hydroxycyclohexyl)-[(3S,5S)-5-methylheptan-3-yl]ammonium IUPAC Name: (4-hydroxycyclohexyl)-[(3S,5S)-5-methylheptan-3-yl]azanium Traditional Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-(4-hydroxycyclohexyl)ammonium Formula: C14H30NO+ MolecularWeight: 228.3941

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)[NH2+]C1CCC(CC1)O

Isomeric SMILES

CC[C@H](C)C[C@H](CC)[NH2+]C1CCC(CC1)O

InChI

InChI=1S/C14H29NO/c1-4-11(3)10-12(5-2)15-13-6-8-14(16)9-7-13/h11-16H,4-10H2,1-3H3/p+1/t11-,12-,13?,14?/m0/s1