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

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-[2-(4-methylphenoxy)ethyl]propanamide Openeye Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-[2-(4-methylphenoxy)ethyl]propanamide CAS Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-[2-(4-methylphenoxy)ethyl]propanamide IUPAC Name: 3-(1,3-dioxo-4H-isoquinolin-2-yl)-N-[2-(4-methylphenoxy)ethyl]propanamide Traditional Name: 3-(1,3-diketo-4H-isoquinolin-2-yl)-N-[2-(4-methylphenoxy)ethyl]propionamide Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCNC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=C(C=C1)OCCNC(=O)CCN2C(=O)CC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H22N2O4/c1-15-6-8-17(9-7-15)27-13-11-22-19(24)10-12-23-20(25)14-16-4-2-3-5-18(16)21(23)26/h2-9H,10-14H2,1H3,(H,22,24)