[cyano-(3-phenoxyphenyl)methyl] 2,2-dimethyl-3-[(E)-2-phenylsulfanylethenyl]cyclopropane-1-carboxylate

Systemtic Name: [cyano-(3-phenoxyphenyl)methyl] 2,2-dimethyl-3-[(E)-2-phenylsulfanylethenyl]cyclopropane-1-carboxylate Openeye Name: [cyano-(3-phenoxyphenyl)methyl] 2,2-dimethyl-3-[(E)-2-phenylsulfanylvinyl]cyclopropanecarboxylate CAS Name: 2,2-dimethyl-3-[(E)-2-(phenylthio)ethenyl]-1-cyclopropanecarboxylic acid [cyano-(3-phenoxyphenyl)methyl] ester IUPAC Name: [cyano-(3-phenoxyphenyl)methyl] 2,2-dimethyl-3-[(E)-2-phenylsulfanylethenyl]cyclopropane-1-carboxylate Traditional Name: 2,2-dimethyl-3-[(E)-2-(phenylthio)vinyl]cyclopropanecarboxylic acid [cyano-(3-phenoxyphenyl)methyl] ester Formula: C28H25NO3S MolecularWeight: 455.568

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)C=CSC4=CC=CC=C4)C

Isomeric SMILES

CC1(C(C1C(=O)OC(C#N)C2=CC(=CC=C2)OC3=CC=CC=C3)/C=C/SC4=CC=CC=C4)C

InChI

InChI=1S/C28H25NO3S/c1-28(2)24(16-17-33-23-14-7-4-8-15-23)26(28)27(30)32-25(19-29)20-10-9-13-22(18-20)31-21-11-5-3-6-12-21/h3-18,24-26H,1-2H3/b17-16+