(6S)-6-(hydroxymethyl)-1,2,3-trimethoxy-9-methylsulfanyl-5,6-dihydrocyclohepta[a]naphthalen-8-one

Systemtic Name: (6S)-6-(hydroxymethyl)-1,2,3-trimethoxy-9-methylsulfanyl-5,6-dihydrocyclohepta[a]naphthalen-8-one Openeye Name: (6S)-6-(hydroxymethyl)-1,2,3-trimethoxy-9-methylsulfanyl-5,6-dihydrocyclohepta[a]naphthalen-8-one CAS Name: (6S)-6-(hydroxymethyl)-1,2,3-trimethoxy-9-(methylthio)-5,6-dihydrocyclohepta[a]naphthalen-8-one IUPAC Name: (6S)-6-(hydroxymethyl)-1,2,3-trimethoxy-9-methylsulfanyl-5,6-dihydrocyclohepta[a]naphthalen-8-one Traditional Name: (6S)-1,2,3-trimethoxy-6-methylol-9-(methylthio)-5,6-dihydrocyclohepta[a]naphthalen-8-one Formula: C20H22O5S MolecularWeight: 374.45068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C2C(=C1)CC(C3=CC(=O)C(=CC=C32)SC)CO)OC)OC

Isomeric SMILES

COC1=C(C(=C2C(=C1)C[C@@H](C3=CC(=O)C(=CC=C32)SC)CO)OC)OC

InChI

InChI=1S/C20H22O5S/c1-23-16-8-11-7-12(10-21)14-9-15(22)17(26-4)6-5-13(14)18(11)20(25-3)19(16)24-2/h5-6,8-9,12,21H,7,10H2,1-4H3/t12-/m1/s1