[(6S)-1,2,3-trimethoxy-9-methylsulfanyl-8-oxidanylidene-5,6-dihydrocyclohepta[a]naphthalen-6-yl]methyl propanoate

Systemtic Name: [(6S)-1,2,3-trimethoxy-9-methylsulfanyl-8-oxidanylidene-5,6-dihydrocyclohepta[a]naphthalen-6-yl]methyl propanoate Openeye Name: [(6S)-1,2,3-trimethoxy-9-methylsulfanyl-8-oxo-5,6-dihydrocyclohepta[a]naphthalen-6-yl]methyl propanoate CAS Name: propanoic acid [(6S)-1,2,3-trimethoxy-9-(methylthio)-8-oxo-5,6-dihydrocyclohepta[a]naphthalen-6-yl]methyl ester IUPAC Name: [(6S)-1,2,3-trimethoxy-9-methylsulfanyl-8-oxo-5,6-dihydrocyclohepta[a]naphthalen-6-yl]methyl propanoate Traditional Name: propionic acid [(6S)-8-keto-1,2,3-trimethoxy-9-(methylthio)-5,6-dihydrocyclohepta[a]naphthalen-6-yl]methyl ester Formula: C23H26O6S MolecularWeight: 430.51394

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OCC1CC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC

Isomeric SMILES

CCC(=O)OC[C@H]1CC2=CC(=C(C(=C2C3=CC=C(C(=O)C=C13)SC)OC)OC)OC

InChI

InChI=1S/C23H26O6S/c1-6-20(25)29-12-14-9-13-10-18(26-2)22(27-3)23(28-4)21(13)15-7-8-19(30-5)17(24)11-16(14)15/h7-8,10-11,14H,6,9,12H2,1-5H3/t14-/m1/s1