O1-tert-butyl O5-methyl (E,4E)-4-(phenylsulfanylmethylidene)pent-2-enedioate

Systemtic Name: O1-tert-butyl O5-methyl (E,4E)-4-(phenylsulfanylmethylidene)pent-2-enedioate Openeye Name: O1-tert-butyl O5-methyl (E,4E)-4-(phenylsulfanylmethylene)pent-2-enedioate CAS Name: (E,4E)-4-[(phenylthio)methylidene]-2-pentenedioic acid O1-tert-butyl ester O5-methyl ester IUPAC Name: 1-O-tert-butyl 5-O-methyl (E,4E)-4-(phenylsulfanylmethylidene)pent-2-enedioate Traditional Name: (E,4E)-4-[(phenylthio)methylene]pent-2-enedioic acid O1-tert-butyl ester O5-methyl ester Formula: C17H20O4S MolecularWeight: 320.4033

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C=CC(=CSC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)/C=C/C(=C\SC1=CC=CC=C1)/C(=O)OC

InChI

InChI=1S/C17H20O4S/c1-17(2,3)21-15(18)11-10-13(16(19)20-4)12-22-14-8-6-5-7-9-14/h5-12H,1-4H3/b11-10+,13-12+