[(2S)-6-methylheptan-2-yl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: [(2S)-6-methylheptan-2-yl]-(thiophen-3-ylmethyl)azanium Openeye Name: [(1S)-1,5-dimethylhexyl]-(3-thienylmethyl)ammonium CAS Name: [(2S)-6-methylheptan-2-yl]-(3-thiophenylmethyl)ammonium IUPAC Name: [(2S)-6-methylheptan-2-yl]-(thiophen-3-ylmethyl)azanium Traditional Name: [(1S)-1,5-dimethylhexyl]-(3-thenyl)ammonium Formula: C13H24NS+ MolecularWeight: 226.40136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)[NH2+]CC1=CSC=C1

Isomeric SMILES

C[C@@H](CCCC(C)C)[NH2+]CC1=CSC=C1

InChI

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