(2-chloranyl-4-methyl-pentyl) 4-[4-(2-chloranyl-4-methyl-pentoxy)carbonylphenyl]benzoate

Systemtic Name: (2-chloranyl-4-methyl-pentyl) 4-[4-(2-chloranyl-4-methyl-pentoxy)carbonylphenyl]benzoate Openeye Name: (2-chloro-4-methyl-pentyl) 4-[4-(2-chloro-4-methyl-pentoxy)carbonylphenyl]benzoate CAS Name: 4-[4-[(2-chloro-4-methylpentoxy)-oxomethyl]phenyl]benzoic acid (2-chloro-4-methylpentyl) ester IUPAC Name: (2-chloro-4-methylpentyl) 4-[4-(2-chloro-4-methylpentoxy)carbonylphenyl]benzoate Traditional Name: 4-[4-(2-chloro-4-methyl-pentoxy)carbonylphenyl]benzoic acid (2-chloro-4-methyl-pentyl) ester Formula: C26H32Cl2O4 MolecularWeight: 479.43588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC(CC(C)C)Cl)Cl

Isomeric SMILES

CC(C)CC(COC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OCC(CC(C)C)Cl)Cl

InChI

InChI=1S/C26H32Cl2O4/c1-17(2)13-23(27)15-31-25(29)21-9-5-19(6-10-21)20-7-11-22(12-8-20)26(30)32-16-24(28)14-18(3)4/h5-12,17-18,23-24H,13-16H2,1-4H3