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

Systemtic Name: 3-methoxypropyl-[(3S,5S)-5-methylheptan-3-yl]azanium Openeye Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-(3-methoxypropyl)ammonium CAS Name: 3-methoxypropyl-[(3S,5S)-5-methylheptan-3-yl]ammonium IUPAC Name: 3-methoxypropyl-[(3S,5S)-5-methylheptan-3-yl]azanium Traditional Name: [(1S,3S)-1-ethyl-3-methyl-pentyl]-(3-methoxypropyl)ammonium Formula: C12H28NO+ MolecularWeight: 202.35682

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H27NO/c1-5-11(3)10-12(6-2)13-8-7-9-14-4/h11-13H,5-10H2,1-4H3/p+1/t11-,12-/m0/s1