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

Systemtic Name: N-[(6-chloranyl-2-methyl-1-oxidanylidene-4-phenyl-isoquinolin-3-yl)methyl]-1H-indole-2-carboxamide Openeye Name: N-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolyl)methyl]-1H-indole-2-carboxamide CAS Name: N-[(6-chloro-2-methyl-1-oxo-4-phenyl-3-isoquinolinyl)methyl]-1H-indole-2-carboxamide IUPAC Name: N-[(6-chloro-2-methyl-1-oxo-4-phenylisoquinolin-3-yl)methyl]-1H-indole-2-carboxamide Traditional Name: N-[(6-chloro-1-keto-2-methyl-4-phenyl-3-isoquinolyl)methyl]-1H-indole-2-carboxamide Formula: C26H20ClN3O2 MolecularWeight: 441.9089

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)CNC(=O)C4=CC5=CC=CC=C5N4

Isomeric SMILES

CN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)CNC(=O)C4=CC5=CC=CC=C5N4

InChI

InChI=1S/C26H20ClN3O2/c1-30-23(15-28-25(31)22-13-17-9-5-6-10-21(17)29-22)24(16-7-3-2-4-8-16)20-14-18(27)11-12-19(20)26(30)32/h2-14,29H,15H2,1H3,(H,28,31)