bis[(2S)-2-methylpentyl] 3-(4-phenylphenyl)benzene-1,2-dicarboxylate

Systemtic Name: bis[(2S)-2-methylpentyl] 3-(4-phenylphenyl)benzene-1,2-dicarboxylate Openeye Name: bis[(2S)-2-methylpentyl] 3-(4-phenylphenyl)benzene-1,2-dicarboxylate CAS Name: 3-(4-phenylphenyl)benzene-1,2-dicarboxylic acid bis[(2S)-2-methylpentyl] ester IUPAC Name: bis[(2S)-2-methylpentyl] 3-(4-phenylphenyl)benzene-1,2-dicarboxylate Traditional Name: 3-(4-phenylphenyl)benzene-1,2-dicarboxylic acid bis[(2S)-2-methylpentyl] ester Formula: C32H38O4 MolecularWeight: 486.64172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)COC(=O)C1=CC=CC(=C1C(=O)OCC(C)CCC)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C32H38O4/c1-5-11-23(3)21-35-31(33)29-16-10-15-28(30(29)32(34)36-22-24(4)12-6-2)27-19-17-26(18-20-27)25-13-8-7-9-14-25/h7-10,13-20,23-24H,5-6,11-12,21-22H2,1-4H3/t23-,24-/m0/s1