(E)-3-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propylsulfanyl]-2-methyl-prop-2-enoate

Systemtic Name: (E)-3-[3-(3,5-ditert-butyl-4-oxidanyl-phenyl)propylsulfanyl]-2-methyl-prop-2-enoate Openeye Name: (E)-3-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propylsulfanyl]-2-methyl-prop-2-enoate CAS Name: (E)-3-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylthio]-2-methyl-2-propenoate IUPAC Name: (E)-3-[3-(3,5-ditert-butyl-4-hydroxyphenyl)propylsulfanyl]-2-methylprop-2-enoate Traditional Name: (E)-3-[3-(3,5-ditert-butyl-4-hydroxy-phenyl)propylthio]-2-methyl-acrylate Formula: C21H31O3S- MolecularWeight: 363.53404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CSCCCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)C(=O)[O-]

Isomeric SMILES

C/C(=C\SCCCC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)/C(=O)[O-]

InChI

InChI=1S/C21H32O3S/c1-14(19(23)24)13-25-10-8-9-15-11-16(20(2,3)4)18(22)17(12-15)21(5,6)7/h11-13,22H,8-10H2,1-7H3,(H,23,24)/p-1/b14-13+