[dihexyl(thiiran-2-ylmethyl)azaniumyl]methanethioate

Systemtic Name: [dihexyl(thiiran-2-ylmethyl)azaniumyl]methanethioate Openeye Name: [dihexyl(thiiran-2-ylmethyl)ammonio]methanethioate CAS Name: [dihexyl(2-thiiranylmethyl)ammonio]methanethioate IUPAC Name: [dihexyl(thiiran-2-ylmethyl)azaniumyl]methanethioate Traditional Name: [dihexyl(thiiran-2-ylmethyl)ammonio]thioformate Formula: C16H31NOS2 MolecularWeight: 317.55344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC[N+](CCCCCC)(CC1CS1)C(=S)[O-]

Isomeric SMILES

CCCCCC[N+](CCCCCC)(CC1CS1)C(=S)[O-]

InChI

InChI=1S/C16H31NOS2/c1-3-5-7-9-11-17(16(18)19,13-15-14-20-15)12-10-8-6-4-2/h15H,3-14H2,1-2H3