bis[(2R)-2-cyano-3-methyl-butyl] 3-(4-phenylphenyl)benzene-1,2-dicarboxylate

Systemtic Name: bis[(2R)-2-cyano-3-methyl-butyl] 3-(4-phenylphenyl)benzene-1,2-dicarboxylate Openeye Name: bis[(2R)-2-cyano-3-methyl-butyl] 3-(4-phenylphenyl)benzene-1,2-dicarboxylate CAS Name: 3-(4-phenylphenyl)benzene-1,2-dicarboxylic acid bis[(2R)-2-cyano-3-methylbutyl] ester IUPAC Name: bis[(2R)-2-cyano-3-methylbutyl] 3-(4-phenylphenyl)benzene-1,2-dicarboxylate Traditional Name: 3-(4-phenylphenyl)benzene-1,2-dicarboxylic acid bis[(2R)-2-cyano-3-methyl-butyl] ester Formula: C32H32N2O4 MolecularWeight: 508.60748

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(COC(=O)C1=CC=CC(=C1C(=O)OCC(C#N)C(C)C)C2=CC=C(C=C2)C3=CC=CC=C3)C#N

Isomeric SMILES

CC(C)[C@@H](COC(=O)C1=CC=CC(=C1C(=O)OC[C@@H](C#N)C(C)C)C2=CC=C(C=C2)C3=CC=CC=C3)C#N

InChI

InChI=1S/C32H32N2O4/c1-21(2)26(17-33)19-37-31(35)29-12-8-11-28(30(29)32(36)38-20-27(18-34)22(3)4)25-15-13-24(14-16-25)23-9-6-5-7-10-23/h5-16,21-22,26-27H,19-20H2,1-4H3/t26-,27-/m1/s1