(6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl) 2-ethoxybenzoate

Systemtic Name: (6-chloranyl-2-oxidanylidene-4-propyl-chromen-7-yl) 2-ethoxybenzoate Openeye Name: (6-chloro-2-oxo-4-propyl-chromen-7-yl) 2-ethoxybenzoate CAS Name: 2-ethoxybenzoic acid (6-chloro-2-oxo-4-propyl-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-2-oxo-4-propylchromen-7-yl) 2-ethoxybenzoate Traditional Name: 2-ethoxybenzoic acid (6-chloro-2-keto-4-propyl-chromen-7-yl) ester Formula: C21H19ClO5 MolecularWeight: 386.82556

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C3=CC=CC=C3OCC

Isomeric SMILES

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C3=CC=CC=C3OCC

InChI

InChI=1S/C21H19ClO5/c1-3-7-13-10-20(23)26-18-12-19(16(22)11-15(13)18)27-21(24)14-8-5-6-9-17(14)25-4-2/h5-6,8-12H,3-4,7H2,1-2H3