3-[[(4S)-2,2-dimethyloxan-4-yl]methyl-(thiophen-2-ylmethyl)amino]propyl-diethyl-azanium

Systemtic Name: 3-[[(4S)-2,2-dimethyloxan-4-yl]methyl-(thiophen-2-ylmethyl)amino]propyl-diethyl-azanium Openeye Name: 3-[[(4S)-2,2-dimethyltetrahydropyran-4-yl]methyl-(2-thienylmethyl)amino]propyl-diethyl-ammonium CAS Name: 3-[[(4S)-2,2-dimethyl-4-oxanyl]methyl-(thiophen-2-ylmethyl)amino]propyl-diethylammonium IUPAC Name: 3-[[(4S)-2,2-dimethyloxan-4-yl]methyl-(thiophen-2-ylmethyl)amino]propyl-diethylazanium Traditional Name: 3-[[(4S)-2,2-dimethyltetrahydropyran-4-yl]methyl-(2-thenyl)amino]propyl-diethyl-ammonium Formula: C20H37N2OS+ MolecularWeight: 353.58558

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN(CC1CCOC(C1)(C)C)CC2=CC=CS2

Isomeric SMILES

CC[NH+](CC)CCCN(C[C@H]1CCOC(C1)(C)C)CC2=CC=CS2

InChI

InChI=1S/C20H36N2OS/c1-5-21(6-2)11-8-12-22(17-19-9-7-14-24-19)16-18-10-13-23-20(3,4)15-18/h7,9,14,18H,5-6,8,10-13,15-17H2,1-4H3/p+1/t18-/m0/s1