2-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]-N-methyl-benzamide

Systemtic Name: 2-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]-N-methyl-benzamide Openeye Name: 2-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)methyl]-N-methyl-benzamide CAS Name: 2-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl]-N-methylbenzamide IUPAC Name: 2-[(6-chloro-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)methyl]-N-methylbenzamide Traditional Name: 2-[(6-chloro-1-keto-2-methyl-4-phenyl-3-isoquinolyl)methyl]-N-methyl-benzamide Formula: C25H21ClN2O2 MolecularWeight: 416.89944

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=CC=C1CC2=C(C3=C(C=CC(=C3)Cl)C(=O)N2C)C4=CC=CC=C4

Isomeric SMILES

CNC(=O)C1=CC=CC=C1CC2=C(C3=C(C=CC(=C3)Cl)C(=O)N2C)C4=CC=CC=C4

InChI

InChI=1S/C25H21ClN2O2/c1-27-24(29)19-11-7-6-10-17(19)14-22-23(16-8-4-3-5-9-16)21-15-18(26)12-13-20(21)25(30)28(22)2/h3-13,15H,14H2,1-2H3,(H,27,29)