4-[[cyclopropyl-[(2-fluorophenyl)methyl]amino]methyl]-6-ethyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[cyclopropyl-[(2-fluorophenyl)methyl]amino]methyl]-6-ethyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[cyclopropyl-[(2-fluorophenyl)methyl]amino]methyl]-6-ethyl-7-hydroxy-chromen-2-one CAS Name: 4-[[cyclopropyl-[(2-fluorophenyl)methyl]amino]methyl]-6-ethyl-7-hydroxy-1-benzopyran-2-one IUPAC Name: 4-[[cyclopropyl-[(2-fluorophenyl)methyl]amino]methyl]-6-ethyl-7-hydroxychromen-2-one Traditional Name: 4-[[cyclopropyl-(2-fluorobenzyl)amino]methyl]-6-ethyl-7-hydroxy-coumarin Formula: C22H22FNO3 MolecularWeight: 367.413383

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN(CC3=CC=CC=C3F)C4CC4)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CN(CC3=CC=CC=C3F)C4CC4)O

InChI

InChI=1S/C22H22FNO3/c1-2-14-9-18-16(10-22(26)27-21(18)11-20(14)25)13-24(17-7-8-17)12-15-5-3-4-6-19(15)23/h3-6,9-11,17,25H,2,7-8,12-13H2,1H3