4-butyl-7-[(4-chlorophenyl)methoxy]chromen-2-one

Systemtic Name: 4-butyl-7-[(4-chlorophenyl)methoxy]chromen-2-one Openeye Name: 4-butyl-7-[(4-chlorophenyl)methoxy]chromen-2-one CAS Name: 4-butyl-7-[(4-chlorophenyl)methoxy]-1-benzopyran-2-one IUPAC Name: 4-butyl-7-[(4-chlorophenyl)methoxy]chromen-2-one Traditional Name: 4-butyl-7-(4-chlorobenzyl)oxy-coumarin Formula: C20H19ClO3 MolecularWeight: 342.81606

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19ClO3/c1-2-3-4-15-11-20(22)24-19-12-17(9-10-18(15)19)23-13-14-5-7-16(21)8-6-14/h5-12H,2-4,13H2,1H3