3-(2-chlorophenyl)-N-[2-(2-methoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[2-(2-methoxyethyl)-1-oxidanylidene-isoquinolin-5-yl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[2-(2-methoxyethyl)-1-oxo-5-isoquinolyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[2-(2-methoxyethyl)-1-oxo-5-isoquinolinyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[2-(2-methoxyethyl)-1-oxoisoquinolin-5-yl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[1-keto-2-(2-methoxyethyl)-5-isoquinolyl]propionamide Formula: C21H21ClN2O3 MolecularWeight: 384.85604

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C=CC2=C(C1=O)C=CC=C2NC(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

COCCN1C=CC2=C(C1=O)C=CC=C2NC(=O)CCC3=CC=CC=C3Cl

InChI

InChI=1S/C21H21ClN2O3/c1-27-14-13-24-12-11-16-17(21(24)26)6-4-8-19(16)23-20(25)10-9-15-5-2-3-7-18(15)22/h2-8,11-12H,9-10,13-14H2,1H3,(H,23,25)