4-butyl-7-phenacyloxy-chromen-2-one

Systemtic Name: 4-butyl-7-phenacyloxy-chromen-2-one Openeye Name: 4-butyl-7-phenacyloxy-chromen-2-one CAS Name: 4-butyl-7-phenacyloxy-1-benzopyran-2-one IUPAC Name: 4-butyl-7-phenacyloxychromen-2-one Traditional Name: 4-butyl-7-phenacyloxy-coumarin Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)C3=CC=CC=C3

InChI

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