Molecule ID: 5284654

IUPAC Name: 4-ethyl-7-hydroxy-3-(4-methoxyphenyl)chromen-2-one

Description: The molecule is a hydroxycoumarin that is coumarin substituted by an ethyl group at position 4, a hydroxy group at position 7 and a p-methoxyphenyl group at position 3 respectively. It is a hydroxycoumarin and a monomethoxybenzene. It derives from a coumarin.

SMILES: CCc1c(-c2ccc(OC)cc2)c(=O)oc2cc(O)ccc12

SELFIES: [C][C][C][=C][Branch1][=N][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][=Branch1][C][=O][O][C][=C][C][Branch1][C][O][=C][C][=C][Ring2][Ring1][Ring2][Ring1][#Branch1]

InChI: InChI=1S/C18H16O4/c1-3-14-15-9-6-12(19)10-16(15)22-18(20)17(14)11-4-7-13(21-2)8-5-11/h4-10,19H,3H2,1-2H3

Molecular Properties:
- Polar Surface Area: 55.8 Ų
- LogP: 3.5