(4-methoxyphenyl) 2-(1,2,3-trimethoxy-9-methylsulfanyl-8-oxidanylidene-5,6-dihydrocyclohepta[a]naphthalen-6-yl)ethanoate

Systemtic Name: (4-methoxyphenyl) 2-(1,2,3-trimethoxy-9-methylsulfanyl-8-oxidanylidene-5,6-dihydrocyclohepta[a]naphthalen-6-yl)ethanoate Openeye Name: (4-methoxyphenyl) 2-(1,2,3-trimethoxy-9-methylsulfanyl-8-oxo-5,6-dihydrocyclohepta[a]naphthalen-6-yl)acetate CAS Name: 2-[1,2,3-trimethoxy-9-(methylthio)-8-oxo-5,6-dihydrocyclohepta[a]naphthalen-6-yl]acetic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 2-(1,2,3-trimethoxy-9-methylsulfanyl-8-oxo-5,6-dihydrocyclohepta[a]naphthalen-6-yl)acetate Traditional Name: 2-[8-keto-1,2,3-trimethoxy-9-(methylthio)-5,6-dihydrocyclohepta[a]naphthalen-6-yl]acetic acid (4-methoxyphenyl) ester Formula: C28H28O7S MolecularWeight: 508.58272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC(=O)CC2CC3=CC(=C(C(=C3C4=CC=C(C(=O)C=C24)SC)OC)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)OC(=O)CC2CC3=CC(=C(C(=C3C4=CC=C(C(=O)C=C24)SC)OC)OC)OC

InChI

InChI=1S/C28H28O7S/c1-31-18-6-8-19(9-7-18)35-25(30)14-16-12-17-13-23(32-2)27(33-3)28(34-4)26(17)20-10-11-24(36-5)22(29)15-21(16)20/h6-11,13,15-16H,12,14H2,1-5H3