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

Systemtic Name: bis[(2S)-nonan-2-yl] 3-(4-phenylphenyl)benzene-1,2-dicarboxylate Openeye Name: bis[(1S)-1-methyloctyl] 3-(4-phenylphenyl)benzene-1,2-dicarboxylate CAS Name: 3-(4-phenylphenyl)benzene-1,2-dicarboxylic acid bis[(2S)-nonan-2-yl] ester IUPAC Name: bis[(2S)-nonan-2-yl] 3-(4-phenylphenyl)benzene-1,2-dicarboxylate Traditional Name: 3-(4-phenylphenyl)benzene-1,2-dicarboxylic acid bis[(1S)-1-methyloctyl] ester Formula: C38H50O4 MolecularWeight: 570.8012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C)OC(=O)C1=CC=CC(=C1C(=O)OC(C)CCCCCCC)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C38H50O4/c1-5-7-9-11-14-19-29(3)41-37(39)35-24-18-23-34(33-27-25-32(26-28-33)31-21-16-13-17-22-31)36(35)38(40)42-30(4)20-15-12-10-8-6-2/h13,16-18,21-30H,5-12,14-15,19-20H2,1-4H3/t29-,30-/m0/s1