6-chloranyl-3-hexyl-4-methyl-7-[(3-methylphenyl)methoxy]chromen-2-one

Systemtic Name: 6-chloranyl-3-hexyl-4-methyl-7-[(3-methylphenyl)methoxy]chromen-2-one Openeye Name: 6-chloro-3-hexyl-4-methyl-7-(m-tolylmethoxy)chromen-2-one CAS Name: 6-chloro-3-hexyl-4-methyl-7-[(3-methylphenyl)methoxy]-1-benzopyran-2-one IUPAC Name: 6-chloro-3-hexyl-4-methyl-7-[(3-methylphenyl)methoxy]chromen-2-one Traditional Name: 6-chloro-3-hexyl-4-methyl-7-(3-methylbenzyl)oxy-coumarin Formula: C24H27ClO3 MolecularWeight: 398.92238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=CC=CC(=C3)C)Cl)C

Isomeric SMILES

CCCCCCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=CC=CC(=C3)C)Cl)C

InChI

InChI=1S/C24H27ClO3/c1-4-5-6-7-11-19-17(3)20-13-21(25)23(14-22(20)28-24(19)26)27-15-18-10-8-9-16(2)12-18/h8-10,12-14H,4-7,11,15H2,1-3H3