quinolin-2-ylmethyl 2-(2-oxidanylidenepropylsulfanyl)benzoate

Systemtic Name: quinolin-2-ylmethyl 2-(2-oxidanylidenepropylsulfanyl)benzoate Openeye Name: 2-quinolylmethyl 2-acetonylsulfanylbenzoate CAS Name: 2-(2-oxopropylthio)benzoic acid 2-quinolinylmethyl ester IUPAC Name: quinolin-2-ylmethyl 2-(2-oxopropylsulfanyl)benzoate Traditional Name: 2-(acetonylthio)benzoic acid 2-quinolylmethyl ester Formula: C20H17NO3S MolecularWeight: 351.41888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=CC=CC=C1C(=O)OCC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(=O)CSC1=CC=CC=C1C(=O)OCC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H17NO3S/c1-14(22)13-25-19-9-5-3-7-17(19)20(23)24-12-16-11-10-15-6-2-4-8-18(15)21-16/h2-11H,12-13H2,1H3