4-chloranyl-3-methyl-N-[1-oxidanylidene-2-(pyridin-3-ylmethyl)isoquinolin-5-yl]benzamide

Systemtic Name: 4-chloranyl-3-methyl-N-[1-oxidanylidene-2-(pyridin-3-ylmethyl)isoquinolin-5-yl]benzamide Openeye Name: 4-chloro-3-methyl-N-[1-oxo-2-(3-pyridylmethyl)-5-isoquinolyl]benzamide CAS Name: 4-chloro-3-methyl-N-[1-oxo-2-(3-pyridinylmethyl)-5-isoquinolinyl]benzamide IUPAC Name: 4-chloro-3-methyl-N-[1-oxo-2-(pyridin-3-ylmethyl)isoquinolin-5-yl]benzamide Traditional Name: 4-chloro-N-[1-keto-2-(3-pyridylmethyl)-5-isoquinolyl]-3-methyl-benzamide Formula: C23H18ClN3O2 MolecularWeight: 403.86092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4=CN=CC=C4)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4=CN=CC=C4)Cl

InChI

InChI=1S/C23H18ClN3O2/c1-15-12-17(7-8-20(15)24)22(28)26-21-6-2-5-19-18(21)9-11-27(23(19)29)14-16-4-3-10-25-13-16/h2-13H,14H2,1H3,(H,26,28)