4-methyl-7-(2-oxidanylidenepropoxy)-3-(phenylmethyl)chromen-2-one

Systemtic Name: 4-methyl-7-(2-oxidanylidenepropoxy)-3-(phenylmethyl)chromen-2-one Openeye Name: 7-acetonyloxy-3-benzyl-4-methyl-chromen-2-one CAS Name: 4-methyl-7-(2-oxopropoxy)-3-(phenylmethyl)-1-benzopyran-2-one IUPAC Name: 3-benzyl-4-methyl-7-(2-oxopropoxy)chromen-2-one Traditional Name: 7-acetonyloxy-3-benzyl-4-methyl-coumarin Formula: C20H18O4 MolecularWeight: 322.35452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)C)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2)OCC(=O)C)CC3=CC=CC=C3

InChI

InChI=1S/C20H18O4/c1-13(21)12-23-16-8-9-17-14(2)18(20(22)24-19(17)11-16)10-15-6-4-3-5-7-15/h3-9,11H,10,12H2,1-2H3