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

Systemtic Name: 4-[[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]methyl]-7-methoxy-chromen-2-one CAS Name: 4-[[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[1,3-benzodioxol-5-ylmethyl(cyclopentyl)amino]methyl]-7-methoxychromen-2-one Traditional Name: 4-[[cyclopentyl(piperonyl)amino]methyl]-7-methoxy-coumarin Formula: C24H25NO5 MolecularWeight: 407.459

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN(CC3=CC4=C(C=C3)OCO4)C5CCCC5

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN(CC3=CC4=C(C=C3)OCO4)C5CCCC5

InChI

InChI=1S/C24H25NO5/c1-27-19-7-8-20-17(11-24(26)30-22(20)12-19)14-25(18-4-2-3-5-18)13-16-6-9-21-23(10-16)29-15-28-21/h6-12,18H,2-5,13-15H2,1H3