7-methyl-5-[2-(4-methylphenyl)-2-oxidanylidene-ethoxy]-4-propyl-chromen-2-one

Systemtic Name: 7-methyl-5-[2-(4-methylphenyl)-2-oxidanylidene-ethoxy]-4-propyl-chromen-2-one Openeye Name: 7-methyl-5-[2-oxo-2-(p-tolyl)ethoxy]-4-propyl-chromen-2-one CAS Name: 7-methyl-5-[2-(4-methylphenyl)-2-oxoethoxy]-4-propyl-1-benzopyran-2-one IUPAC Name: 7-methyl-5-[2-(4-methylphenyl)-2-oxoethoxy]-4-propylchromen-2-one Traditional Name: 5-[2-keto-2-(p-tolyl)ethoxy]-7-methyl-4-propyl-coumarin Formula: C22H22O4 MolecularWeight: 350.40768

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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