3-ethoxypropyl-[(3R,5R)-5-methylheptan-3-yl]azanium

Systemtic Name: 3-ethoxypropyl-[(3R,5R)-5-methylheptan-3-yl]azanium Openeye Name: 3-ethoxypropyl-[(1R,3R)-1-ethyl-3-methyl-pentyl]ammonium CAS Name: 3-ethoxypropyl-[(3R,5R)-5-methylheptan-3-yl]ammonium IUPAC Name: 3-ethoxypropyl-[(3R,5R)-5-methylheptan-3-yl]azanium Traditional Name: 3-ethoxypropyl-[(1R,3R)-1-ethyl-3-methyl-pentyl]ammonium Formula: C13H30NO+ MolecularWeight: 216.3834

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC(CC)[NH2+]CCCOCC

Isomeric SMILES

CC[C@@H](C)C[C@@H](CC)[NH2+]CCCOCC

InChI

InChI=1S/C13H29NO/c1-5-12(4)11-13(6-2)14-9-8-10-15-7-3/h12-14H,5-11H2,1-4H3/p+1/t12-,13-/m1/s1