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

Systemtic Name: 3-chloranyl-4-methoxy-N-[1-oxidanylidene-2-(pyridin-3-ylmethyl)isoquinolin-5-yl]benzamide Openeye Name: 3-chloro-4-methoxy-N-[1-oxo-2-(3-pyridylmethyl)-5-isoquinolyl]benzamide CAS Name: 3-chloro-4-methoxy-N-[1-oxo-2-(3-pyridinylmethyl)-5-isoquinolinyl]benzamide IUPAC Name: 3-chloro-4-methoxy-N-[1-oxo-2-(pyridin-3-ylmethyl)isoquinolin-5-yl]benzamide Traditional Name: 3-chloro-N-[1-keto-2-(3-pyridylmethyl)-5-isoquinolyl]-4-methoxy-benzamide Formula: C23H18ClN3O3 MolecularWeight: 419.86032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4=CN=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC3=C2C=CN(C3=O)CC4=CN=CC=C4)Cl

InChI

InChI=1S/C23H18ClN3O3/c1-30-21-8-7-16(12-19(21)24)22(28)26-20-6-2-5-18-17(20)9-11-27(23(18)29)14-15-4-3-10-25-13-15/h2-13H,14H2,1H3,(H,26,28)