3-(aminomethyl)-6-chloranyl-2-methyl-4-[4-(trifluoromethyl)phenyl]isoquinolin-1-one

Systemtic Name: 3-(aminomethyl)-6-chloranyl-2-methyl-4-[4-(trifluoromethyl)phenyl]isoquinolin-1-one Openeye Name: 3-(aminomethyl)-6-chloro-2-methyl-4-[4-(trifluoromethyl)phenyl]isoquinolin-1-one CAS Name: 3-(aminomethyl)-6-chloro-2-methyl-4-[4-(trifluoromethyl)phenyl]-1-isoquinolinone IUPAC Name: 3-(aminomethyl)-6-chloro-2-methyl-4-[4-(trifluoromethyl)phenyl]isoquinolin-1-one Traditional Name: 3-(aminomethyl)-6-chloro-2-methyl-4-[4-(trifluoromethyl)phenyl]isocarbostyril Formula: C18H14ClF3N2O MolecularWeight: 366.76477

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=C(C=C3)C(F)(F)F)CN

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=C(C=C3)C(F)(F)F)CN

InChI

InChI=1S/C18H14ClF3N2O/c1-24-15(9-23)16(10-2-4-11(5-3-10)18(20,21)22)14-8-12(19)6-7-13(14)17(24)25/h2-8H,9,23H2,1H3