2-[[1-[2-(phenylmethylsulfanyl)ethyl]-3,4-dihydro-2H-quinolin-5-yl]oxy]ethanoic acid

Systemtic Name: 2-[[1-[2-(phenylmethylsulfanyl)ethyl]-3,4-dihydro-2H-quinolin-5-yl]oxy]ethanoic acid Openeye Name: 2-[[1-(2-benzylsulfanylethyl)-3,4-dihydro-2H-quinolin-5-yl]oxy]acetic acid CAS Name: 2-[[1-[2-(phenylmethylthio)ethyl]-3,4-dihydro-2H-quinolin-5-yl]oxy]acetic acid IUPAC Name: 2-[[1-(2-benzylsulfanylethyl)-3,4-dihydro-2H-quinolin-5-yl]oxy]acetic acid Traditional Name: 2-[[1-[2-(benzylthio)ethyl]-3,4-dihydro-2H-quinolin-5-yl]oxy]acetic acid Formula: C20H23NO3S MolecularWeight: 357.46652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2OCC(=O)O)N(C1)CCSCC3=CC=CC=C3

Isomeric SMILES

C1CC2=C(C=CC=C2OCC(=O)O)N(C1)CCSCC3=CC=CC=C3

InChI

InChI=1S/C20H23NO3S/c22-20(23)14-24-19-10-4-9-18-17(19)8-5-11-21(18)12-13-25-15-16-6-2-1-3-7-16/h1-4,6-7,9-10H,5,8,11-15H2,(H,22,23)