4-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 4-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-7-hydroxy-chromen-2-one CAS Name: 4-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[[1,3-benzodioxol-5-ylmethyl(methyl)amino]methyl]-7-hydroxychromen-2-one Traditional Name: 7-hydroxy-4-[[methyl(piperonyl)amino]methyl]coumarin Formula: C19H17NO5 MolecularWeight: 339.34198

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)CC3=CC(=O)OC4=C3C=CC(=C4)O

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)CC3=CC(=O)OC4=C3C=CC(=C4)O

InChI

InChI=1S/C19H17NO5/c1-20(9-12-2-5-16-18(6-12)24-11-23-16)10-13-7-19(22)25-17-8-14(21)3-4-15(13)17/h2-8,21H,9-11H2,1H3