(2-octylphenyl) 4-(1-heptoxyethyl)benzoate

Systemtic Name: (2-octylphenyl) 4-(1-heptoxyethyl)benzoate Openeye Name: (2-octylphenyl) 4-(1-heptoxyethyl)benzoate CAS Name: 4-(1-heptoxyethyl)benzoic acid (2-octylphenyl) ester IUPAC Name: (2-octylphenyl) 4-(1-heptoxyethyl)benzoate Traditional Name: 4-(1-heptoxyethyl)benzoic acid (2-octylphenyl) ester Formula: C30H44O3 MolecularWeight: 452.66856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCCCCCC

Isomeric SMILES

CCCCCCCCC1=CC=CC=C1OC(=O)C2=CC=C(C=C2)C(C)OCCCCCCC

InChI

InChI=1S/C30H44O3/c1-4-6-8-10-11-13-17-27-18-14-15-19-29(27)33-30(31)28-22-20-26(21-23-28)25(3)32-24-16-12-9-7-5-2/h14-15,18-23,25H,4-13,16-17,24H2,1-3H3