1-phenyldecyl 4-(4-octoxyphenyl)benzoate

Systemtic Name: 1-phenyldecyl 4-(4-octoxyphenyl)benzoate Openeye Name: 1-phenyldecyl 4-(4-octoxyphenyl)benzoate CAS Name: 4-(4-octoxyphenyl)benzoic acid 1-phenyldecyl ester IUPAC Name: 1-phenyldecyl 4-(4-octoxyphenyl)benzoate Traditional Name: 4-(4-octoxyphenyl)benzoic acid 1-phenyldecyl ester Formula: C37H50O3 MolecularWeight: 542.7911

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)C3=CC=C(C=C3)OCCCCCCCC

InChI

InChI=1S/C37H50O3/c1-3-5-7-9-11-12-17-21-36(33-19-15-14-16-20-33)40-37(38)34-24-22-31(23-25-34)32-26-28-35(29-27-32)39-30-18-13-10-8-6-4-2/h14-16,19-20,22-29,36H,3-13,17-18,21,30H2,1-2H3