hexyl 3-ethyl-2-phenyl-benzoate

Systemtic Name: hexyl 3-ethyl-2-phenyl-benzoate Openeye Name: hexyl 3-ethyl-2-phenyl-benzoate CAS Name: 3-ethyl-2-phenylbenzoic acid hexyl ester IUPAC Name: hexyl 3-ethyl-2-phenylbenzoate Traditional Name: 3-ethyl-2-phenyl-benzoic acid hexyl ester Formula: C21H26O2 MolecularWeight: 310.42994

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=C(C(=CC=C1)CC)C2=CC=CC=C2

Isomeric SMILES

CCCCCCOC(=O)C1=C(C(=CC=C1)CC)C2=CC=CC=C2

InChI

InChI=1S/C21H26O2/c1-3-5-6-10-16-23-21(22)19-15-11-14-17(4-2)20(19)18-12-8-7-9-13-18/h7-9,11-15H,3-6,10,16H2,1-2H3