[(2S)-octan-2-yl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: [(2S)-octan-2-yl]-(thiophen-2-ylmethyl)azanium Openeye Name: [(1S)-1-methylheptyl]-(2-thienylmethyl)ammonium CAS Name: [(2S)-octan-2-yl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: [(2S)-octan-2-yl]-(thiophen-2-ylmethyl)azanium Traditional Name: [(1S)-1-methylheptyl]-(2-thenyl)ammonium Formula: C13H24NS+ MolecularWeight: 226.40136

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)[NH2+]CC1=CC=CS1

Isomeric SMILES

CCCCCC[C@H](C)[NH2+]CC1=CC=CS1

InChI

InChI=1S/C13H23NS/c1-3-4-5-6-8-12(2)14-11-13-9-7-10-15-13/h7,9-10,12,14H,3-6,8,11H2,1-2H3/p+1/t12-/m0/s1