methyl 4-methylsulfanyl-6-naphthalen-1-yl-2-oxidanylidene-pyran-3-carboxylate

Systemtic Name: methyl 4-methylsulfanyl-6-naphthalen-1-yl-2-oxidanylidene-pyran-3-carboxylate Openeye Name: methyl 4-methylsulfanyl-6-(1-naphthyl)-2-oxo-pyran-3-carboxylate CAS Name: 4-(methylthio)-6-(1-naphthalenyl)-2-oxo-3-pyrancarboxylic acid methyl ester IUPAC Name: methyl 4-methylsulfanyl-6-naphthalen-1-yl-2-oxopyran-3-carboxylate Traditional Name: 2-keto-4-(methylthio)-6-(1-naphthyl)pyran-3-carboxylic acid methyl ester Formula: C18H14O4S MolecularWeight: 326.36636

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(OC1=O)C2=CC=CC3=CC=CC=C32)SC

Isomeric SMILES

COC(=O)C1=C(C=C(OC1=O)C2=CC=CC3=CC=CC=C32)SC

InChI

InChI=1S/C18H14O4S/c1-21-17(19)16-15(23-2)10-14(22-18(16)20)13-9-5-7-11-6-3-4-8-12(11)13/h3-10H,1-2H3