N-(2-morpholin-4-ium-4-ylethyl)-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(1-oxidanylideneisoquinolin-2-yl)ethanamide Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(1-oxo-2-isoquinolyl)acetamide CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-2-(1-oxo-2-isoquinolinyl)acetamide IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-2-(1-oxoisoquinolin-2-yl)acetamide Traditional Name: 2-(1-keto-2-isoquinolyl)-N-(2-morpholin-4-ium-4-ylethyl)acetamide Formula: C17H22N3O3+ MolecularWeight: 316.37488

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC(=O)CN2C=CC3=CC=CC=C3C2=O

Isomeric SMILES

C1COCC[NH+]1CCNC(=O)CN2C=CC3=CC=CC=C3C2=O

InChI

InChI=1S/C17H21N3O3/c21-16(18-6-8-19-9-11-23-12-10-19)13-20-7-5-14-3-1-2-4-15(14)17(20)22/h1-5,7H,6,8-13H2,(H,18,21)/p+1