8-chloranyl-N-[cyclobutyl-(2-fluorophenyl)methyl]-3-methyl-1-oxidanylidene-2-phenyl-isoquinoline-4-carboxamide

Systemtic Name: 8-chloranyl-N-[cyclobutyl-(2-fluorophenyl)methyl]-3-methyl-1-oxidanylidene-2-phenyl-isoquinoline-4-carboxamide Openeye Name: 8-chloro-N-[cyclobutyl-(2-fluorophenyl)methyl]-3-methyl-1-oxo-2-phenyl-isoquinoline-4-carboxamide CAS Name: 8-chloro-N-[cyclobutyl-(2-fluorophenyl)methyl]-3-methyl-1-oxo-2-phenyl-4-isoquinolinecarboxamide IUPAC Name: 8-chloro-N-[cyclobutyl-(2-fluorophenyl)methyl]-3-methyl-1-oxo-2-phenylisoquinoline-4-carboxamide Traditional Name: 8-chloro-N-[cyclobutyl-(2-fluorophenyl)methyl]-1-keto-3-methyl-2-phenyl-isoquinoline-4-carboxamide Formula: C28H24ClFN2O2 MolecularWeight: 474.953763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C(=CC=C2)Cl)C(=O)N1C3=CC=CC=C3)C(=O)NC(C4CCC4)C5=CC=CC=C5F

Isomeric SMILES

CC1=C(C2=C(C(=CC=C2)Cl)C(=O)N1C3=CC=CC=C3)C(=O)NC(C4CCC4)C5=CC=CC=C5F

InChI

InChI=1S/C28H24ClFN2O2/c1-17-24(27(33)31-26(18-9-7-10-18)20-13-5-6-16-23(20)30)21-14-8-15-22(29)25(21)28(34)32(17)19-11-3-2-4-12-19/h2-6,8,11-16,18,26H,7,9-10H2,1H3,(H,31,33)