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

Systemtic Name: 2-[4-[(2R)-2-(4-butoxyphenyl)sulfanyl-3-ethoxy-2-methyl-3-oxidanylidene-propyl]phenoxy]ethyl-diethyl-azanium Openeye Name: 2-[4-[(2R)-2-(4-butoxyphenyl)sulfanyl-3-ethoxy-2-methyl-3-oxo-propyl]phenoxy]ethyl-diethyl-ammonium CAS Name: 2-[4-[(2R)-2-[(4-butoxyphenyl)thio]-3-ethoxy-2-methyl-3-oxopropyl]phenoxy]ethyl-diethylammonium IUPAC Name: 2-[4-[(2R)-2-(4-butoxyphenyl)sulfanyl-3-ethoxy-2-methyl-3-oxopropyl]phenoxy]ethyl-diethylazanium Traditional Name: 2-[4-[(2R)-2-[(4-butoxyphenyl)thio]-3-ethoxy-3-keto-2-methyl-propyl]phenoxy]ethyl-diethyl-ammonium Formula: C28H42NO4S+ MolecularWeight: 488.70238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)SC(C)(CC2=CC=C(C=C2)OCC[NH+](CC)CC)C(=O)OCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S[C@](C)(CC2=CC=C(C=C2)OCC[NH+](CC)CC)C(=O)OCC

InChI

InChI=1S/C28H41NO4S/c1-6-10-20-32-25-15-17-26(18-16-25)34-28(5,27(30)31-9-4)22-23-11-13-24(14-12-23)33-21-19-29(7-2)8-3/h11-18H,6-10,19-22H2,1-5H3/p+1/t28-/m1/s1