pentamethyl 5-phenylsulfanylcyclopenta-1,3-diene-1,2,3,4,5-pentacarboxylate

Systemtic Name: pentamethyl 5-phenylsulfanylcyclopenta-1,3-diene-1,2,3,4,5-pentacarboxylate Openeye Name: pentamethyl 5-phenylsulfanylcyclopenta-1,3-diene-1,2,3,4,5-pentacarboxylate CAS Name: 5-(phenylthio)cyclopenta-1,3-diene-1,2,3,4,5-pentacarboxylic acid pentamethyl ester IUPAC Name: pentamethyl 5-phenylsulfanylcyclopenta-1,3-diene-1,2,3,4,5-pentacarboxylate Traditional Name: 5-(phenylthio)cyclopenta-1,3-diene-1,2,3,4,5-pentacarboxylic acid pentamethyl ester Formula: C21H20O10S MolecularWeight: 464.4425

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(C(=C1C(=O)OC)C(=O)OC)(C(=O)OC)SC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(C(C(=C1C(=O)OC)C(=O)OC)(C(=O)OC)SC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C21H20O10S/c1-27-16(22)12-13(17(23)28-2)15(19(25)30-4)21(20(26)31-5,14(12)18(24)29-3)32-11-9-7-6-8-10-11/h6-10H,1-5H3