[(1S)-1-(4-tert-butylphenyl)-2-[2-(2-methoxyphenoxy)ethanoylamino]ethyl]-diethyl-azanium

Systemtic Name: [(1S)-1-(4-tert-butylphenyl)-2-[2-(2-methoxyphenoxy)ethanoylamino]ethyl]-diethyl-azanium Openeye Name: [(1S)-1-(4-tert-butylphenyl)-2-[[2-(2-methoxyphenoxy)acetyl]amino]ethyl]-diethyl-ammonium CAS Name: [(1S)-1-(4-tert-butylphenyl)-2-[[2-(2-methoxyphenoxy)-1-oxoethyl]amino]ethyl]-diethylammonium IUPAC Name: [(1S)-1-(4-tert-butylphenyl)-2-[[2-(2-methoxyphenoxy)acetyl]amino]ethyl]-diethylazanium Traditional Name: [(1S)-1-(4-tert-butylphenyl)-2-[[2-(2-methoxyphenoxy)acetyl]amino]ethyl]-diethyl-ammonium Formula: C25H37N2O3+ MolecularWeight: 413.57288

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)COC1=CC=CC=C1OC)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)COC1=CC=CC=C1OC)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C25H36N2O3/c1-7-27(8-2)21(19-13-15-20(16-14-19)25(3,4)5)17-26-24(28)18-30-23-12-10-9-11-22(23)29-6/h9-16,21H,7-8,17-18H2,1-6H3,(H,26,28)/p+1/t21-/m1/s1