[[3-(4-acetamidophenoxy)phenyl]-cyano-methyl] 5,5-bis(chloranyl)-3-methyl-2-propan-2-yl-pent-4-enoate

Systemtic Name: [[3-(4-acetamidophenoxy)phenyl]-cyano-methyl] 5,5-bis(chloranyl)-3-methyl-2-propan-2-yl-pent-4-enoate Openeye Name: [[3-(4-acetamidophenoxy)phenyl]-cyano-methyl] 5,5-dichloro-2-isopropyl-3-methyl-pent-4-enoate CAS Name: 5,5-dichloro-3-methyl-2-propan-2-yl-4-pentenoic acid [[3-(4-acetamidophenoxy)phenyl]-cyanomethyl] ester IUPAC Name: [[3-(4-acetamidophenoxy)phenyl]-cyanomethyl] 5,5-dichloro-3-methyl-2-propan-2-ylpent-4-enoate Traditional Name: 5,5-dichloro-2-isopropyl-3-methyl-pent-4-enoic acid [[3-(4-acetamidophenoxy)phenyl]-cyano-methyl] ester Formula: C25H26Cl2N2O4 MolecularWeight: 489.39094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26Cl2N2O4/c1-15(2)24(16(3)12-23(26)27)25(31)33-22(14-28)18-6-5-7-21(13-18)32-20-10-8-19(9-11-20)29-17(4)30/h5-13,15-16,22,24H,1-4H3,(H,29,30)