[4-acetyloxy-6-chloranyl-2,3-bis(2-chloranylphenoxy)naphthalen-1-yl] 2,2-dimethylpentanoate

Systemtic Name: [4-acetyloxy-6-chloranyl-2,3-bis(2-chloranylphenoxy)naphthalen-1-yl] 2,2-dimethylpentanoate Openeye Name: [4-acetoxy-6-chloro-2,3-bis(2-chlorophenoxy)-1-naphthyl] 2,2-dimethylpentanoate CAS Name: 2,2-dimethylpentanoic acid [4-acetyloxy-6-chloro-2,3-bis(2-chlorophenoxy)-1-naphthalenyl] ester IUPAC Name: [4-acetyloxy-6-chloro-2,3-bis(2-chlorophenoxy)naphthalen-1-yl] 2,2-dimethylpentanoate Traditional Name: 2,2-dimethylvaleric acid [4-acetoxy-6-chloro-2,3-bis(2-chlorophenoxy)-1-naphthyl] ester Formula: C31H27Cl3O6 MolecularWeight: 601.90148

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(C)C(=O)OC1=C(C(=C(C2=C1C=CC(=C2)Cl)OC(=O)C)OC3=CC=CC=C3Cl)OC4=CC=CC=C4Cl

Isomeric SMILES

CCCC(C)(C)C(=O)OC1=C(C(=C(C2=C1C=CC(=C2)Cl)OC(=O)C)OC3=CC=CC=C3Cl)OC4=CC=CC=C4Cl

InChI

InChI=1S/C31H27Cl3O6/c1-5-16-31(3,4)30(36)40-26-20-15-14-19(32)17-21(20)27(37-18(2)35)29(39-25-13-9-7-11-23(25)34)28(26)38-24-12-8-6-10-22(24)33/h6-15,17H,5,16H2,1-4H3