methyl 4-oxidanylidene-8-propyl-7-sulfanyl-chromene-2-carboxylate

Systemtic Name: methyl 4-oxidanylidene-8-propyl-7-sulfanyl-chromene-2-carboxylate Openeye Name: methyl 4-oxo-8-propyl-7-sulfanyl-chromene-2-carboxylate CAS Name: 7-mercapto-4-oxo-8-propyl-1-benzopyran-2-carboxylic acid methyl ester IUPAC Name: methyl 4-oxo-8-propyl-7-sulfanylchromene-2-carboxylate Traditional Name: 4-keto-7-mercapto-8-propyl-chromene-2-carboxylic acid methyl ester Formula: C14H14O4S MolecularWeight: 278.32356

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC2=C1OC(=CC2=O)C(=O)OC)S

Isomeric SMILES

CCCC1=C(C=CC2=C1OC(=CC2=O)C(=O)OC)S

InChI

InChI=1S/C14H14O4S/c1-3-4-9-12(19)6-5-8-10(15)7-11(14(16)17-2)18-13(8)9/h5-7,19H,3-4H2,1-2H3