5,7-diethoxy-4-methyl-3-(phenylmethyl)chromen-2-one

Systemtic Name: 5,7-diethoxy-4-methyl-3-(phenylmethyl)chromen-2-one Openeye Name: 3-benzyl-5,7-diethoxy-4-methyl-chromen-2-one CAS Name: 5,7-diethoxy-4-methyl-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-5,7-diethoxy-4-methylchromen-2-one Traditional Name: 3-benzyl-5,7-diethoxy-4-methyl-coumarin Formula: C21H22O4 MolecularWeight: 338.39698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C2C(=C(C(=O)OC2=C1)CC3=CC=CC=C3)C)OCC

Isomeric SMILES

CCOC1=CC(=C2C(=C(C(=O)OC2=C1)CC3=CC=CC=C3)C)OCC

InChI

InChI=1S/C21H22O4/c1-4-23-16-12-18(24-5-2)20-14(3)17(21(22)25-19(20)13-16)11-15-9-7-6-8-10-15/h6-10,12-13H,4-5,11H2,1-3H3