7-methyl-5-phenacyloxy-4-propyl-chromen-2-one

Systemtic Name: 7-methyl-5-phenacyloxy-4-propyl-chromen-2-one Openeye Name: 7-methyl-5-phenacyloxy-4-propyl-chromen-2-one CAS Name: 7-methyl-5-phenacyloxy-4-propyl-1-benzopyran-2-one IUPAC Name: 7-methyl-5-phenacyloxy-4-propylchromen-2-one Traditional Name: 7-methyl-5-phenacyloxy-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)C)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C21H20O4/c1-3-7-16-12-20(23)25-19-11-14(2)10-18(21(16)19)24-13-17(22)15-8-5-4-6-9-15/h4-6,8-12H,3,7,13H2,1-2H3