4-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-amino]methyl]-7-methoxy-chromen-2-one

Systemtic Name: 4-[[(2-chloranyl-6-fluoranyl-phenyl)methyl-cyclopropyl-amino]methyl]-7-methoxy-chromen-2-one Openeye Name: 4-[[(2-chloro-6-fluoro-phenyl)methyl-cyclopropyl-amino]methyl]-7-methoxy-chromen-2-one CAS Name: 4-[[(2-chloro-6-fluorophenyl)methyl-cyclopropylamino]methyl]-7-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[(2-chloro-6-fluorophenyl)methyl-cyclopropylamino]methyl]-7-methoxychromen-2-one Traditional Name: 4-[[(2-chloro-6-fluoro-benzyl)-cyclopropyl-amino]methyl]-7-methoxy-coumarin Formula: C21H19ClFNO3 MolecularWeight: 387.831863

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN(CC3=C(C=CC=C3Cl)F)C4CC4

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CN(CC3=C(C=CC=C3Cl)F)C4CC4

InChI

InChI=1S/C21H19ClFNO3/c1-26-15-7-8-16-13(9-21(25)27-20(16)10-15)11-24(14-5-6-14)12-17-18(22)3-2-4-19(17)23/h2-4,7-10,14H,5-6,11-12H2,1H3