3-oxidanylidenehexan-2-yl 4-(4-hexylphenyl)benzoate

Systemtic Name: 3-oxidanylidenehexan-2-yl 4-(4-hexylphenyl)benzoate Openeye Name: (1-methyl-2-oxo-pentyl) 4-(4-hexylphenyl)benzoate CAS Name: 4-(4-hexylphenyl)benzoic acid 3-oxohexan-2-yl ester IUPAC Name: 3-oxohexan-2-yl 4-(4-hexylphenyl)benzoate Traditional Name: 4-(4-hexylphenyl)benzoic acid (2-keto-1-methyl-pentyl) ester Formula: C25H32O3 MolecularWeight: 380.51978

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)C(=O)CCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)C(=O)CCC

InChI

InChI=1S/C25H32O3/c1-4-6-7-8-10-20-11-13-21(14-12-20)22-15-17-23(18-16-22)25(27)28-19(3)24(26)9-5-2/h11-19H,4-10H2,1-3H3