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

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)propanamide Openeye Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide CAS Name: N-(4-chloro-2-methoxy-5-methylphenyl)-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide IUPAC Name: N-(4-chloro-2-methoxy-5-methylphenyl)-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-3-(1,3-diketo-4H-isoquinolin-2-yl)propionamide Formula: C20H19ClN2O4 MolecularWeight: 386.82886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H19ClN2O4/c1-12-9-16(17(27-2)11-15(12)21)22-18(24)7-8-23-19(25)10-13-5-3-4-6-14(13)20(23)26/h3-6,9,11H,7-8,10H2,1-2H3,(H,22,24)