hexyl 2-thiophen-2-ylcarbonylbenzoate

Systemtic Name: hexyl 2-thiophen-2-ylcarbonylbenzoate Openeye Name: hexyl 2-(thiophene-2-carbonyl)benzoate CAS Name: 2-[oxo(thiophen-2-yl)methyl]benzoic acid hexyl ester IUPAC Name: hexyl 2-(thiophene-2-carbonyl)benzoate Traditional Name: 2-(2-thenoyl)benzoic acid hexyl ester Formula: C18H20O3S MolecularWeight: 316.4146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=CC=C1C(=O)C2=CC=CS2

Isomeric SMILES

CCCCCCOC(=O)C1=CC=CC=C1C(=O)C2=CC=CS2

InChI

InChI=1S/C18H20O3S/c1-2-3-4-7-12-21-18(20)15-10-6-5-9-14(15)17(19)16-11-8-13-22-16/h5-6,8-11,13H,2-4,7,12H2,1H3