(4-octoxycarbonylphenyl) 4-[3-methyl-4-(2-methylbutoxy)phenyl]benzoate

Systemtic Name: (4-octoxycarbonylphenyl) 4-[3-methyl-4-(2-methylbutoxy)phenyl]benzoate Openeye Name: (4-octoxycarbonylphenyl) 4-[3-methyl-4-(2-methylbutoxy)phenyl]benzoate CAS Name: 4-[3-methyl-4-(2-methylbutoxy)phenyl]benzoic acid [4-[octoxy(oxo)methyl]phenyl] ester IUPAC Name: (4-octoxycarbonylphenyl) 4-[3-methyl-4-(2-methylbutoxy)phenyl]benzoate Traditional Name: 4-[3-methyl-4-(2-methylbutoxy)phenyl]benzoic acid (4-octoxycarbonylphenyl) ester Formula: C34H42O5 MolecularWeight: 530.69428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC(=C(C=C3)OCC(C)CC)C

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)C3=CC(=C(C=C3)OCC(C)CC)C

InChI

InChI=1S/C34H42O5/c1-5-7-8-9-10-11-22-37-33(35)28-16-19-31(20-17-28)39-34(36)29-14-12-27(13-15-29)30-18-21-32(26(4)23-30)38-24-25(3)6-2/h12-21,23,25H,5-11,22,24H2,1-4H3