6-butanoyl-7-methoxy-4-phenyl-chromen-2-one

Systemtic Name: 6-butanoyl-7-methoxy-4-phenyl-chromen-2-one Openeye Name: 6-butanoyl-7-methoxy-4-phenyl-chromen-2-one CAS Name: 7-methoxy-6-(1-oxobutyl)-4-phenyl-1-benzopyran-2-one IUPAC Name: 6-butanoyl-7-methoxy-4-phenylchromen-2-one Traditional Name: 6-butyryl-7-methoxy-4-phenyl-coumarin Formula: C20H18O4 MolecularWeight: 322.35452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(C=C2C(=C1)C(=CC(=O)O2)C3=CC=CC=C3)OC

Isomeric SMILES

CCCC(=O)C1=C(C=C2C(=C1)C(=CC(=O)O2)C3=CC=CC=C3)OC

InChI

InChI=1S/C20H18O4/c1-3-7-17(21)16-10-15-14(13-8-5-4-6-9-13)11-20(22)24-19(15)12-18(16)23-2/h4-6,8-12H,3,7H2,1-2H3