2H-chromen-2-yl 2-methyl-3-(phenylcarbonylsulfanyl)propanoate

Systemtic Name: 2H-chromen-2-yl 2-methyl-3-(phenylcarbonylsulfanyl)propanoate Openeye Name: 2H-chromen-2-yl 3-benzoylsulfanyl-2-methyl-propanoate CAS Name: 3-(benzoylthio)-2-methylpropanoic acid 2H-1-benzopyran-2-yl ester IUPAC Name: 2H-chromen-2-yl 3-benzoylsulfanyl-2-methylpropanoate Traditional Name: 3-(benzoylthio)-2-methyl-propionic acid 2H-chromen-2-yl ester Formula: C20H18O4S MolecularWeight: 354.41952

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C1=CC=CC=C1)C(=O)OC2C=CC3=CC=CC=C3O2

Isomeric SMILES

CC(CSC(=O)C1=CC=CC=C1)C(=O)OC2C=CC3=CC=CC=C3O2

InChI

InChI=1S/C20H18O4S/c1-14(13-25-20(22)16-8-3-2-4-9-16)19(21)24-18-12-11-15-7-5-6-10-17(15)23-18/h2-12,14,18H,13H2,1H3