methyl 4-oxidanylidene-3-(6-oxidanylnaphthalen-2-yl)sulfanyl-pentanoate

Systemtic Name: methyl 4-oxidanylidene-3-(6-oxidanylnaphthalen-2-yl)sulfanyl-pentanoate Openeye Name: methyl 3-[(6-hydroxy-2-naphthyl)sulfanyl]-4-oxo-pentanoate CAS Name: 3-[(6-hydroxy-2-naphthalenyl)thio]-4-oxopentanoic acid methyl ester IUPAC Name: methyl 3-(6-hydroxynaphthalen-2-yl)sulfanyl-4-oxopentanoate Traditional Name: 3-[(6-hydroxy-2-naphthyl)thio]-4-keto-valeric acid methyl ester Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC(=O)OC)SC1=CC2=C(C=C1)C=C(C=C2)O

Isomeric SMILES

CC(=O)C(CC(=O)OC)SC1=CC2=C(C=C1)C=C(C=C2)O

InChI

InChI=1S/C16H16O4S/c1-10(17)15(9-16(19)20-2)21-14-6-4-11-7-13(18)5-3-12(11)8-14/h3-8,15,18H,9H2,1-2H3