octan-4-yl 3-[4-(2-methylbutyl)phenyl]-4-phenyl-benzoate

Systemtic Name: octan-4-yl 3-[4-(2-methylbutyl)phenyl]-4-phenyl-benzoate Openeye Name: 1-propylpentyl 3-[4-(2-methylbutyl)phenyl]-4-phenyl-benzoate CAS Name: 3-[4-(2-methylbutyl)phenyl]-4-phenylbenzoic acid octan-4-yl ester IUPAC Name: octan-4-yl 3-[4-(2-methylbutyl)phenyl]-4-phenylbenzoate Traditional Name: 3-[4-(2-methylbutyl)phenyl]-4-phenyl-benzoic acid 1-propylpentyl ester Formula: C32H40O2 MolecularWeight: 456.6588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCC)OC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2)C3=CC=C(C=C3)CC(C)CC

Isomeric SMILES

CCCCC(CCC)OC(=O)C1=CC(=C(C=C1)C2=CC=CC=C2)C3=CC=C(C=C3)CC(C)CC

InChI

InChI=1S/C32H40O2/c1-5-8-15-29(12-6-2)34-32(33)28-20-21-30(26-13-10-9-11-14-26)31(23-28)27-18-16-25(17-19-27)22-24(4)7-3/h9-11,13-14,16-21,23-24,29H,5-8,12,15,22H2,1-4H3