2-[4-[(2S)-3-ethoxy-2-(4-ethoxyphenyl)sulfanyl-2-methyl-3-oxidanylidene-propyl]phenoxy]ethyl-diethyl-azanium

Systemtic Name: 2-[4-[(2S)-3-ethoxy-2-(4-ethoxyphenyl)sulfanyl-2-methyl-3-oxidanylidene-propyl]phenoxy]ethyl-diethyl-azanium Openeye Name: 2-[4-[(2S)-3-ethoxy-2-(4-ethoxyphenyl)sulfanyl-2-methyl-3-oxo-propyl]phenoxy]ethyl-diethyl-ammonium CAS Name: 2-[4-[(2S)-3-ethoxy-2-[(4-ethoxyphenyl)thio]-2-methyl-3-oxopropyl]phenoxy]ethyl-diethylammonium IUPAC Name: 2-[4-[(2S)-3-ethoxy-2-(4-ethoxyphenyl)sulfanyl-2-methyl-3-oxopropyl]phenoxy]ethyl-diethylazanium Traditional Name: 2-[4-[(2S)-3-ethoxy-3-keto-2-methyl-2-(p-phenetylthio)propyl]phenoxy]ethyl-diethyl-ammonium Formula: C26H38NO4S+ MolecularWeight: 460.64922

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCOC1=CC=C(C=C1)CC(C)(C(=O)OCC)SC2=CC=C(C=C2)OCC

Isomeric SMILES

CC[NH+](CC)CCOC1=CC=C(C=C1)C[C@@](C)(C(=O)OCC)SC2=CC=C(C=C2)OCC

InChI

InChI=1S/C26H37NO4S/c1-6-27(7-2)18-19-31-23-12-10-21(11-13-23)20-26(5,25(28)30-9-4)32-24-16-14-22(15-17-24)29-8-3/h10-17H,6-9,18-20H2,1-5H3/p+1/t26-/m0/s1