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

Systemtic Name: 7-[2-(4-methylphenyl)-2-oxidanylidene-ethoxy]-4-propyl-chromen-2-one Openeye Name: 7-[2-oxo-2-(p-tolyl)ethoxy]-4-propyl-chromen-2-one CAS Name: 7-[2-(4-methylphenyl)-2-oxoethoxy]-4-propyl-1-benzopyran-2-one IUPAC Name: 7-[2-(4-methylphenyl)-2-oxoethoxy]-4-propylchromen-2-one Traditional Name: 7-[2-keto-2-(p-tolyl)ethoxy]-4-propyl-coumarin Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20O4/c1-3-4-16-11-21(23)25-20-12-17(9-10-18(16)20)24-13-19(22)15-7-5-14(2)6-8-15/h5-12H,3-4,13H2,1-2H3