[cyano-(3-phenoxyphenyl)methyl] 3-tert-butyl-5,5-bis(chloranyl)-2-propan-2-yl-pent-4-enoate

Systemtic Name: [cyano-(3-phenoxyphenyl)methyl] 3-tert-butyl-5,5-bis(chloranyl)-2-propan-2-yl-pent-4-enoate Openeye Name: [cyano-(3-phenoxyphenyl)methyl] 3-tert-butyl-5,5-dichloro-2-isopropyl-pent-4-enoate CAS Name: 3-tert-butyl-5,5-dichloro-2-propan-2-yl-4-pentenoic acid [cyano-(3-phenoxyphenyl)methyl] ester IUPAC Name: [cyano-(3-phenoxyphenyl)methyl] 3-tert-butyl-5,5-dichloro-2-propan-2-ylpent-4-enoate Traditional Name: 3-tert-butyl-5,5-dichloro-2-isopropyl-pent-4-enoic acid [cyano-(3-phenoxyphenyl)methyl] ester Formula: C26H29Cl2NO3 MolecularWeight: 474.41936

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C=C(Cl)Cl)C(C)(C)C)C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(C=C(Cl)Cl)C(C)(C)C)C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2

InChI

InChI=1S/C26H29Cl2NO3/c1-17(2)24(21(15-23(27)28)26(3,4)5)25(30)32-22(16-29)18-10-9-13-20(14-18)31-19-11-7-6-8-12-19/h6-15,17,21-22,24H,1-5H3