1-(2-phenylsulfanylethanoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid

Systemtic Name: 1-(2-phenylsulfanylethanoyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Openeye Name: 1-(2-phenylsulfanylacetyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid CAS Name: 1-[1-oxo-2-(phenylthio)ethyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid IUPAC Name: 1-(2-phenylsulfanylacetyl)-3,4-dihydro-2H-quinoline-5-carboxylic acid Traditional Name: 1-[2-(phenylthio)acetyl]-3,4-dihydro-2H-quinoline-5-carboxylic acid Formula: C18H17NO3S MolecularWeight: 327.39748

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC=C2N(C1)C(=O)CSC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CC2=C(C=CC=C2N(C1)C(=O)CSC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H17NO3S/c20-17(12-23-13-6-2-1-3-7-13)19-11-5-9-14-15(18(21)22)8-4-10-16(14)19/h1-4,6-8,10H,5,9,11-12H2,(H,21,22)