1-[4-(4-pentylphenyl)phenyl]ethyl 2-heptoxypropanoate

Systemtic Name: 1-[4-(4-pentylphenyl)phenyl]ethyl 2-heptoxypropanoate Openeye Name: 1-[4-(4-pentylphenyl)phenyl]ethyl 2-heptoxypropanoate CAS Name: 2-heptoxypropanoic acid 1-[4-(4-pentylphenyl)phenyl]ethyl ester IUPAC Name: 1-[4-(4-pentylphenyl)phenyl]ethyl 2-heptoxypropanoate Traditional Name: 2-heptoxypropionic acid 1-[4-(4-amylphenyl)phenyl]ethyl ester Formula: C29H42O3 MolecularWeight: 438.64198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(C)C(=O)OC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)CCCCC

Isomeric SMILES

CCCCCCCOC(C)C(=O)OC(C)C1=CC=C(C=C1)C2=CC=C(C=C2)CCCCC

InChI

InChI=1S/C29H42O3/c1-5-7-9-10-12-22-31-24(4)29(30)32-23(3)26-18-20-28(21-19-26)27-16-14-25(15-17-27)13-11-8-6-2/h14-21,23-24H,5-13,22H2,1-4H3