methyl 5-oxidanylidene-4-(6-oxidanylnaphthalen-2-yl)sulfanyl-hexanoate

Systemtic Name: methyl 5-oxidanylidene-4-(6-oxidanylnaphthalen-2-yl)sulfanyl-hexanoate Openeye Name: methyl 4-[(6-hydroxy-2-naphthyl)sulfanyl]-5-oxo-hexanoate CAS Name: 4-[(6-hydroxy-2-naphthalenyl)thio]-5-oxohexanoic acid methyl ester IUPAC Name: methyl 4-(6-hydroxynaphthalen-2-yl)sulfanyl-5-oxohexanoate Traditional Name: 4-[(6-hydroxy-2-naphthyl)thio]-5-keto-hexanoic acid methyl ester Formula: C17H18O4S MolecularWeight: 318.38742

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18O4S/c1-11(18)16(7-8-17(20)21-2)22-15-6-4-12-9-14(19)5-3-13(12)10-15/h3-6,9-10,16,19H,7-8H2,1-2H3