3-oxidanylidenenonan-2-yl 4-(4-hexoxyphenyl)benzoate

Systemtic Name: 3-oxidanylidenenonan-2-yl 4-(4-hexoxyphenyl)benzoate Openeye Name: (1-methyl-2-oxo-octyl) 4-(4-hexoxyphenyl)benzoate CAS Name: 4-(4-hexoxyphenyl)benzoic acid 3-oxononan-2-yl ester IUPAC Name: 3-oxononan-2-yl 4-(4-hexoxyphenyl)benzoate Traditional Name: 4-(4-hexoxyphenyl)benzoic acid (2-keto-1-methyl-octyl) ester Formula: C28H38O4 MolecularWeight: 438.59892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)C(C)OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OCCCCCC

Isomeric SMILES

CCCCCCC(=O)C(C)OC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OCCCCCC

InChI

InChI=1S/C28H38O4/c1-4-6-8-10-12-27(29)22(3)32-28(30)25-15-13-23(14-16-25)24-17-19-26(20-18-24)31-21-11-9-7-5-2/h13-20,22H,4-12,21H2,1-3H3