(3-butyl-2-oxidanylidene-chromen-4-yl) 3-methoxybenzoate

Systemtic Name: (3-butyl-2-oxidanylidene-chromen-4-yl) 3-methoxybenzoate Openeye Name: (3-butyl-2-oxo-chromen-4-yl) 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid (3-butyl-2-oxo-1-benzopyran-4-yl) ester IUPAC Name: (3-butyl-2-oxochromen-4-yl) 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid (3-butyl-2-keto-chromen-4-yl) ester Formula: C21H20O5 MolecularWeight: 352.3805

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2OC1=O)OC(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2OC1=O)OC(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H20O5/c1-3-4-10-17-19(16-11-5-6-12-18(16)25-21(17)23)26-20(22)14-8-7-9-15(13-14)24-2/h5-9,11-13H,3-4,10H2,1-2H3