bis(2-chloranylpentan-2-yl) 3-(4-phenylphenyl)benzene-1,2-dicarboxylate

Systemtic Name: bis(2-chloranylpentan-2-yl) 3-(4-phenylphenyl)benzene-1,2-dicarboxylate Openeye Name: bis(1-chloro-1-methyl-butyl) 3-(4-phenylphenyl)benzene-1,2-dicarboxylate CAS Name: 3-(4-phenylphenyl)benzene-1,2-dicarboxylic acid bis(2-chloropentan-2-yl) ester IUPAC Name: bis(2-chloropentan-2-yl) 3-(4-phenylphenyl)benzene-1,2-dicarboxylate Traditional Name: 3-(4-phenylphenyl)benzene-1,2-dicarboxylic acid bis(1-chloro-1-methyl-butyl) ester Formula: C30H32Cl2O4 MolecularWeight: 527.47868

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(OC(=O)C1=CC=CC(=C1C(=O)OC(C)(CCC)Cl)C2=CC=C(C=C2)C3=CC=CC=C3)Cl

Isomeric SMILES

CCCC(C)(OC(=O)C1=CC=CC(=C1C(=O)OC(C)(CCC)Cl)C2=CC=C(C=C2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C30H32Cl2O4/c1-5-19-29(3,31)35-27(33)25-14-10-13-24(26(25)28(34)36-30(4,32)20-6-2)23-17-15-22(16-18-23)21-11-8-7-9-12-21/h7-18H,5-6,19-20H2,1-4H3