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

Systemtic Name: 3-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]-N-[(4-chlorophenyl)methyl]propanamide Openeye Name: N-[(4-chlorophenyl)methyl]-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide CAS Name: N-[(4-chlorophenyl)methyl]-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide IUPAC Name: N-[(4-chlorophenyl)methyl]-3-(1,3-dioxo-4H-isoquinolin-2-yl)propanamide Traditional Name: N-(4-chlorobenzyl)-3-(1,3-diketo-4H-isoquinolin-2-yl)propionamide Formula: C19H17ClN2O3 MolecularWeight: 356.80288

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)N(C1=O)CCC(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1C2=CC=CC=C2C(=O)N(C1=O)CCC(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H17ClN2O3/c20-15-7-5-13(6-8-15)12-21-17(23)9-10-22-18(24)11-14-3-1-2-4-16(14)19(22)25/h1-8H,9-12H2,(H,21,23)