4-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 4-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-7-hydroxy-chromen-2-one CAS Name: 4-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]methyl]-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]methyl]-7-hydroxychromen-2-one Traditional Name: 4-[[homoveratryl(methyl)amino]methyl]-7-hydroxy-coumarin Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)CC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)CC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C21H23NO5/c1-22(9-8-14-4-7-18(25-2)20(10-14)26-3)13-15-11-21(24)27-19-12-16(23)5-6-17(15)19/h4-7,10-12,23H,8-9,13H2,1-3H3