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

Systemtic Name: 4-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-7-ethyl-chromen-2-one Openeye Name: 4-[[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]methyl]-7-ethyl-chromen-2-one CAS Name: 4-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]methyl]-7-ethyl-1-benzopyran-2-one IUPAC Name: 4-[[2-(3,4-dimethoxyphenyl)ethyl-methylamino]methyl]-7-ethylchromen-2-one Traditional Name: 7-ethyl-4-[[homoveratryl(methyl)amino]methyl]coumarin Formula: C23H27NO4 MolecularWeight: 381.46478

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CN(C)CCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CN(C)CCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H27NO4/c1-5-16-6-8-19-18(14-23(25)28-21(19)12-16)15-24(2)11-10-17-7-9-20(26-3)22(13-17)27-4/h6-9,12-14H,5,10-11,15H2,1-4H3