[1-[[[(4S)-3,4-dihydro-2H-thiochromen-4-yl]azaniumyl]methyl]cyclohexyl]-dimethyl-azanium

Systemtic Name: [1-[[[(4S)-3,4-dihydro-2H-thiochromen-4-yl]azaniumyl]methyl]cyclohexyl]-dimethyl-azanium Openeye Name: dimethyl-[1-[[[(4S)-thiochroman-4-yl]ammonio]methyl]cyclohexyl]ammonium CAS Name: [1-[[[(4S)-3,4-dihydro-2H-1-benzothiopyran-4-yl]ammonio]methyl]cyclohexyl]-dimethylammonium IUPAC Name: [1-[[[(4S)-3,4-dihydro-2H-thiochromen-4-yl]azaniumyl]methyl]cyclohexyl]-dimethylazanium Traditional Name: dimethyl-[1-[[[(4S)-thiochroman-4-yl]ammonio]methyl]cyclohexyl]ammonium Formula: C18H30N2S+2 MolecularWeight: 306.5092

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1(CCCCC1)C[NH2+]C2CCSC3=CC=CC=C23

Isomeric SMILES

C[NH+](C)C1(CCCCC1)C[NH2+][C@H]2CCSC3=CC=CC=C23

InChI

InChI=1S/C18H28N2S/c1-20(2)18(11-6-3-7-12-18)14-19-16-10-13-21-17-9-5-4-8-15(16)17/h4-5,8-9,16,19H,3,6-7,10-14H2,1-2H3/p+2/t16-/m0/s1