(2R)-3-[3-[2-(dimethylazaniumyl)ethoxy]phenyl]-2-thiophen-2-yl-propanoate

Systemtic Name: (2R)-3-[3-[2-(dimethylazaniumyl)ethoxy]phenyl]-2-thiophen-2-yl-propanoate Openeye Name: (2R)-3-[3-[2-(dimethylammonio)ethoxy]phenyl]-2-(2-thienyl)propanoate CAS Name: (2R)-3-[3-[2-(dimethylammonio)ethoxy]phenyl]-2-thiophen-2-ylpropanoate IUPAC Name: (2R)-3-[3-[2-(dimethylazaniumyl)ethoxy]phenyl]-2-thiophen-2-ylpropanoate Traditional Name: (2R)-3-[3-[2-(dimethylammonio)ethoxy]phenyl]-2-(2-thienyl)propionate Formula: C17H21NO3S MolecularWeight: 319.41854

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC1=CC=CC(=C1)CC(C2=CC=CS2)C(=O)[O-]

Isomeric SMILES

C[NH+](C)CCOC1=CC=CC(=C1)C[C@@H](C2=CC=CS2)C(=O)[O-]

InChI

InChI=1S/C17H21NO3S/c1-18(2)8-9-21-14-6-3-5-13(11-14)12-15(17(19)20)16-7-4-10-22-16/h3-7,10-11,15H,8-9,12H2,1-2H3,(H,19,20)/t15-/m0/s1