3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-(pyridin-2-ylmethyl)propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-(pyridin-2-ylmethyl)propanamide Openeye Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-(2-pyridylmethyl)propanamide CAS Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-(2-pyridinylmethyl)propanamide IUPAC Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-(pyridin-2-ylmethyl)propanamide Traditional Name: 3-(1,3-diketo-4H-isoquinolin-2-yl)-N-(2-pyridylmethyl)propionamide Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CCC(=O)NCC3=CC=CC=N3

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CCC(=O)NCC3=CC=CC=N3

InChI

InChI=1S/C18H17N3O3/c22-16(20-12-14-6-3-4-9-19-14)8-10-21-17(23)11-13-5-1-2-7-15(13)18(21)24/h1-7,9H,8,10-12H2,(H,20,22)