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

Systemtic Name: 2-butan-2-yl-5,5-bis(chloranyl)-2-[cyano-(3-phenoxyphenyl)methyl]-3-methyl-pent-4-enoate Openeye Name: 5,5-dichloro-2-[cyano-(3-phenoxyphenyl)methyl]-3-methyl-2-sec-butyl-pent-4-enoate CAS Name: 2-butan-2-yl-5,5-dichloro-2-[cyano-(3-phenoxyphenyl)methyl]-3-methyl-4-pentenoate IUPAC Name: 2-butan-2-yl-5,5-dichloro-2-[cyano-(3-phenoxyphenyl)methyl]-3-methylpent-4-enoate Traditional Name: 5,5-dichloro-2-[cyano-(3-phenoxyphenyl)methyl]-3-methyl-2-sec-butyl-pent-4-enoate Formula: C24H24Cl2NO3- MolecularWeight: 445.35826

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C)C=C(Cl)Cl)(C(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CCC(C)C(C(C)C=C(Cl)Cl)(C(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C24H25Cl2NO3/c1-4-16(2)24(23(28)29,17(3)13-22(25)26)21(15-27)18-9-8-12-20(14-18)30-19-10-6-5-7-11-19/h5-14,16-17,21H,4H2,1-3H3,(H,28,29)/p-1