[(2S)-heptan-2-yl]-[3-(2-methylpropoxy)propyl]azanium

Systemtic Name: [(2S)-heptan-2-yl]-[3-(2-methylpropoxy)propyl]azanium Openeye Name: 3-isobutoxypropyl-[(1S)-1-methylhexyl]ammonium CAS Name: [(2S)-heptan-2-yl]-[3-(2-methylpropoxy)propyl]ammonium IUPAC Name: [(2S)-heptan-2-yl]-[3-(2-methylpropoxy)propyl]azanium Traditional Name: 3-isobutoxypropyl-[(1S)-1-methylhexyl]ammonium Formula: C14H32NO+ MolecularWeight: 230.40998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)[NH2+]CCCOCC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C14H31NO/c1-5-6-7-9-14(4)15-10-8-11-16-12-13(2)3/h13-15H,5-12H2,1-4H3/p+1/t14-/m0/s1