6-ethyl-4-[[(2-methoxy-5-methyl-phenyl)amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 6-ethyl-4-[[(2-methoxy-5-methyl-phenyl)amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-[(2-methoxy-5-methyl-anilino)methyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[(2-methoxy-5-methylanilino)methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-[(2-methoxy-5-methylanilino)methyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[(2-methoxy-5-methyl-anilino)methyl]coumarin Formula: C20H21NO4 MolecularWeight: 339.38504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CNC3=C(C=CC(=C3)C)OC)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CNC3=C(C=CC(=C3)C)OC)O

InChI

InChI=1S/C20H21NO4/c1-4-13-8-15-14(9-20(23)25-19(15)10-17(13)22)11-21-16-7-12(2)5-6-18(16)24-3/h5-10,21-22H,4,11H2,1-3H3