8-methyl-7-[(4-methylphenyl)methoxy]-4-propyl-chromen-2-one

Systemtic Name: 8-methyl-7-[(4-methylphenyl)methoxy]-4-propyl-chromen-2-one Openeye Name: 8-methyl-4-propyl-7-(p-tolylmethoxy)chromen-2-one CAS Name: 8-methyl-7-[(4-methylphenyl)methoxy]-4-propyl-1-benzopyran-2-one IUPAC Name: 8-methyl-7-[(4-methylphenyl)methoxy]-4-propylchromen-2-one Traditional Name: 8-methyl-7-(4-methylbenzyl)oxy-4-propyl-coumarin Formula: C21H22O3 MolecularWeight: 322.39758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC3=CC=C(C=C3)C

Isomeric SMILES

CCCC1=CC(=O)OC2=C1C=CC(=C2C)OCC3=CC=C(C=C3)C

InChI

InChI=1S/C21H22O3/c1-4-5-17-12-20(22)24-21-15(3)19(11-10-18(17)21)23-13-16-8-6-14(2)7-9-16/h6-12H,4-5,13H2,1-3H3