2-(4-chlorophenyl)-1-oxidanylidene-N-(pyridin-2-ylmethyl)isoquinoline-4-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-1-oxidanylidene-N-(pyridin-2-ylmethyl)isoquinoline-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-1-oxo-N-(2-pyridylmethyl)isoquinoline-4-carboxamide CAS Name: 2-(4-chlorophenyl)-1-oxo-N-(2-pyridinylmethyl)-4-isoquinolinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-1-oxo-N-(pyridin-2-ylmethyl)isoquinoline-4-carboxamide Traditional Name: 2-(4-chlorophenyl)-1-keto-N-(2-pyridylmethyl)isoquinoline-4-carboxamide Formula: C22H16ClN3O2 MolecularWeight: 389.83434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN(C2=O)C3=CC=C(C=C3)Cl)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN(C2=O)C3=CC=C(C=C3)Cl)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C22H16ClN3O2/c23-15-8-10-17(11-9-15)26-14-20(18-6-1-2-7-19(18)22(26)28)21(27)25-13-16-5-3-4-12-24-16/h1-12,14H,13H2,(H,25,27)