4-[[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]methyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]methyl]-7-methoxy-chromen-2-one CAS Name: 4-[[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]methyl]-7-methoxychromen-2-one Traditional Name: 4-[[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]methyl]-7-methoxy-coumarin Formula: C18H13F2NO5 MolecularWeight: 361.296326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CNC3=CC4=C(C=C3)OC(O4)(F)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CNC3=CC4=C(C=C3)OC(O4)(F)F

InChI

InChI=1S/C18H13F2NO5/c1-23-12-3-4-13-10(6-17(22)24-15(13)8-12)9-21-11-2-5-14-16(7-11)26-18(19,20)25-14/h2-8,21H,9H2,1H3