(3-butyl-2-oxidanylidene-chromen-4-yl) 3,4-dimethylbenzoate

Systemtic Name: (3-butyl-2-oxidanylidene-chromen-4-yl) 3,4-dimethylbenzoate Openeye Name: (3-butyl-2-oxo-chromen-4-yl) 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid (3-butyl-2-oxo-1-benzopyran-4-yl) ester IUPAC Name: (3-butyl-2-oxochromen-4-yl) 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid (3-butyl-2-keto-chromen-4-yl) ester Formula: C22H22O4 MolecularWeight: 350.40768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22O4/c1-4-5-8-18-20(17-9-6-7-10-19(17)25-22(18)24)26-21(23)16-12-11-14(2)15(3)13-16/h6-7,9-13H,4-5,8H2,1-3H3