4-[[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[cyclopropyl-[4-(trifluoromethyl)benzyl]amino]methyl]-7-hydroxy-8-methyl-coumarin Formula: C22H20F3NO3 MolecularWeight: 403.39431

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CN(CC3=CC=C(C=C3)C(F)(F)F)C4CC4)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CN(CC3=CC=C(C=C3)C(F)(F)F)C4CC4)O

InChI

InChI=1S/C22H20F3NO3/c1-13-19(27)9-8-18-15(10-20(28)29-21(13)18)12-26(17-6-7-17)11-14-2-4-16(5-3-14)22(23,24)25/h2-5,8-10,17,27H,6-7,11-12H2,1H3