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

Systemtic Name: N-[3-[(5-methoxy-1-oxidanylidene-2H-isoquinolin-4-yl)methyl]phenyl]propanamide Openeye Name: N-[3-[(5-methoxy-1-oxo-2H-isoquinolin-4-yl)methyl]phenyl]propanamide CAS Name: N-[3-[(5-methoxy-1-oxo-2H-isoquinolin-4-yl)methyl]phenyl]propanamide IUPAC Name: N-[3-[(5-methoxy-1-oxo-2H-isoquinolin-4-yl)methyl]phenyl]propanamide Traditional Name: N-[3-[(1-keto-5-methoxy-2H-isoquinolin-4-yl)methyl]phenyl]propionamide Formula: C20H20N2O3 MolecularWeight: 336.3844

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=CC(=C1)CC2=CNC(=O)C3=C2C(=CC=C3)OC

Isomeric SMILES

CCC(=O)NC1=CC=CC(=C1)CC2=CNC(=O)C3=C2C(=CC=C3)OC

InChI

InChI=1S/C20H20N2O3/c1-3-18(23)22-15-7-4-6-13(11-15)10-14-12-21-20(24)16-8-5-9-17(25-2)19(14)16/h4-9,11-12H,3,10H2,1-2H3,(H,21,24)(H,22,23)