3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-(4-chloranyl-2,5-dimethoxy-phenyl)propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-(4-chloranyl-2,5-dimethoxy-phenyl)propanamide Openeye Name: N-(4-chloro-2,5-dimethoxy-phenyl)-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide CAS Name: N-(4-chloro-2,5-dimethoxyphenyl)-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide IUPAC Name: N-(4-chloro-2,5-dimethoxyphenyl)-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-3-(1,3-diketo-4H-isoquinolin-2-yl)propionamide Formula: C20H19ClN2O5 MolecularWeight: 402.82826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O)OC)Cl

InChI

InChI=1S/C20H19ClN2O5/c1-27-16-11-15(17(28-2)10-14(16)21)22-18(24)7-8-23-19(25)9-12-5-3-4-6-13(12)20(23)26/h3-6,10-11H,7-9H2,1-2H3,(H,22,24)