6-chloranyl-4-[[[(1S)-1-(4-fluorophenyl)-2-methyl-propyl]amino]methyl]-7-methyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-[[[(1S)-1-(4-fluorophenyl)-2-methyl-propyl]amino]methyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[[[(1S)-1-(4-fluorophenyl)-2-methyl-propyl]amino]methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[[[(1S)-1-(4-fluorophenyl)-2-methylpropyl]amino]methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[[[(1S)-1-(4-fluorophenyl)-2-methylpropyl]amino]methyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[[[(1S)-1-(4-fluorophenyl)-2-methyl-propyl]amino]methyl]-7-methyl-coumarin Formula: C21H21ClFNO2 MolecularWeight: 373.848343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)CNC(C3=CC=C(C=C3)F)C(C)C)Cl

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)CN[C@H](C3=CC=C(C=C3)F)C(C)C)Cl

InChI

InChI=1S/C21H21ClFNO2/c1-12(2)21(14-4-6-16(23)7-5-14)24-11-15-9-20(25)26-19-8-13(3)18(22)10-17(15)19/h4-10,12,21,24H,11H2,1-3H3/t21-/m0/s1