1-(4-octylphenyl)ethyl 4-pentoxybenzoate

Systemtic Name: 1-(4-octylphenyl)ethyl 4-pentoxybenzoate Openeye Name: 1-(4-octylphenyl)ethyl 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid 1-(4-octylphenyl)ethyl ester IUPAC Name: 1-(4-octylphenyl)ethyl 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid 1-(4-octylphenyl)ethyl ester Formula: C28H40O3 MolecularWeight: 424.6154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(C)OC(=O)C2=CC=C(C=C2)OCCCCC

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(C)OC(=O)C2=CC=C(C=C2)OCCCCC

InChI

InChI=1S/C28H40O3/c1-4-6-8-9-10-11-13-24-14-16-25(17-15-24)23(3)31-28(29)26-18-20-27(21-19-26)30-22-12-7-5-2/h14-21,23H,4-13,22H2,1-3H3