[4-(4-nonoxyphenoxy)carbonylphenyl] 2-(3,7-dimethyloctoxy)benzoate

Systemtic Name: [4-(4-nonoxyphenoxy)carbonylphenyl] 2-(3,7-dimethyloctoxy)benzoate Openeye Name: [4-(4-nonoxyphenoxy)carbonylphenyl] 2-(3,7-dimethyloctoxy)benzoate CAS Name: 2-(3,7-dimethyloctoxy)benzoic acid [4-[(4-nonoxyphenoxy)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-nonoxyphenoxy)carbonylphenyl] 2-(3,7-dimethyloctoxy)benzoate Traditional Name: 2-(3,7-dimethyloctoxy)benzoic acid [4-(4-nonoxyphenoxy)carbonylphenyl] ester Formula: C39H52O6 MolecularWeight: 616.82658

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3OCCC(C)CCCC(C)C

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=CC=C3OCCC(C)CCCC(C)C

InChI

InChI=1S/C39H52O6/c1-5-6-7-8-9-10-13-28-42-33-23-25-35(26-24-33)44-38(40)32-19-21-34(22-20-32)45-39(41)36-17-11-12-18-37(36)43-29-27-31(4)16-14-15-30(2)3/h11-12,17-26,30-31H,5-10,13-16,27-29H2,1-4H3