4-butyl-7-(1-phenylethoxy)chromen-2-one

Systemtic Name: 4-butyl-7-(1-phenylethoxy)chromen-2-one Openeye Name: 4-butyl-7-(1-phenylethoxy)chromen-2-one CAS Name: 4-butyl-7-(1-phenylethoxy)-1-benzopyran-2-one IUPAC Name: 4-butyl-7-(1-phenylethoxy)chromen-2-one Traditional Name: 4-butyl-7-(1-phenylethoxy)coumarin Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OC(C)C3=CC=CC=C3

InChI

InChI=1S/C21H22O3/c1-3-4-8-17-13-21(22)24-20-14-18(11-12-19(17)20)23-15(2)16-9-6-5-7-10-16/h5-7,9-15H,3-4,8H2,1-2H3