dimethyl-[(1R)-2-[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylamino]-1-thiophen-2-yl-ethyl]azanium

Systemtic Name: dimethyl-[(1R)-2-[2-(5-methyl-2-propan-2-yl-phenoxy)ethanoylamino]-1-thiophen-2-yl-ethyl]azanium Openeye Name: [(1R)-2-[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: dimethyl-[(1R)-2-[[2-(5-methyl-2-propan-2-ylphenoxy)-1-oxoethyl]amino]-1-thiophen-2-ylethyl]ammonium IUPAC Name: dimethyl-[(1R)-2-[[2-(5-methyl-2-propan-2-ylphenoxy)acetyl]amino]-1-thiophen-2-ylethyl]azanium Traditional Name: [(1R)-2-[[2-(2-isopropyl-5-methyl-phenoxy)acetyl]amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C20H29N2O2S+ MolecularWeight: 361.52146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NCC(C2=CC=CS2)[NH+](C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC(=O)NC[C@H](C2=CC=CS2)[NH+](C)C

InChI

InChI=1S/C20H28N2O2S/c1-14(2)16-9-8-15(3)11-18(16)24-13-20(23)21-12-17(22(4)5)19-7-6-10-25-19/h6-11,14,17H,12-13H2,1-5H3,(H,21,23)/p+1/t17-/m1/s1