(7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl) 4-methylbenzoate

Systemtic Name: (7-methyl-2-oxidanylidene-4-propyl-chromen-5-yl) 4-methylbenzoate Openeye Name: (7-methyl-2-oxo-4-propyl-chromen-5-yl) 4-methylbenzoate CAS Name: 4-methylbenzoic acid (7-methyl-2-oxo-4-propyl-1-benzopyran-5-yl) ester IUPAC Name: (7-methyl-2-oxo-4-propylchromen-5-yl) 4-methylbenzoate Traditional Name: 4-methylbenzoic acid (2-keto-7-methyl-4-propyl-chromen-5-yl) ester Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C(=CC(=C2)C)OC(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H20O4/c1-4-5-16-12-19(22)24-17-10-14(3)11-18(20(16)17)25-21(23)15-8-6-13(2)7-9-15/h6-12H,4-5H2,1-3H3