6-ethyl-4-[[methyl-[2-(3-methylphenoxy)ethyl]amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 6-ethyl-4-[[methyl-[2-(3-methylphenoxy)ethyl]amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-[[methyl-[2-(3-methylphenoxy)ethyl]amino]methyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[[methyl-[2-(3-methylphenoxy)ethyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-[[methyl-[2-(3-methylphenoxy)ethyl]amino]methyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[[methyl-[2-(3-methylphenoxy)ethyl]amino]methyl]coumarin Formula: C22H25NO4 MolecularWeight: 367.4382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN(C)CCOC3=CC=CC(=C3)C)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN(C)CCOC3=CC=CC(=C3)C)O

InChI

InChI=1S/C22H25NO4/c1-4-16-11-19-17(12-22(25)27-21(19)13-20(16)24)14-23(3)8-9-26-18-7-5-6-15(2)10-18/h5-7,10-13,24H,4,8-9,14H2,1-3H3