4-[[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]methyl]-6-ethyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]methyl]-6-ethyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]methyl]-6-ethyl-7-hydroxy-chromen-2-one CAS Name: 4-[[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]methyl]-6-ethyl-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]methyl]-6-ethyl-7-hydroxychromen-2-one Traditional Name: 4-[[2,3-dihydro-1,4-benzodioxin-3-ylmethyl(methyl)amino]methyl]-6-ethyl-7-hydroxy-coumarin Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN(C)CC3COC4=CC=CC=C4O3)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN(C)CC3COC4=CC=CC=C4O3)O

InChI

InChI=1S/C22H23NO5/c1-3-14-8-17-15(9-22(25)28-21(17)10-18(14)24)11-23(2)12-16-13-26-19-6-4-5-7-20(19)27-16/h4-10,16,24H,3,11-13H2,1-2H3