N-(3-morpholin-4-ylpropyl)-3-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]propanamide

Systemtic Name: N-(3-morpholin-4-ylpropyl)-3-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]propanamide Openeye Name: N-(3-morpholinopropyl)-3-[[2-(1-oxo-2-isoquinolyl)acetyl]amino]propanamide CAS Name: N-[3-(4-morpholinyl)propyl]-3-[[1-oxo-2-(1-oxo-2-isoquinolinyl)ethyl]amino]propanamide IUPAC Name: N-(3-morpholin-4-ylpropyl)-3-[[2-(1-oxoisoquinolin-2-yl)acetyl]amino]propanamide Traditional Name: 3-[[2-(1-keto-2-isoquinolyl)acetyl]amino]-N-(3-morpholinopropyl)propionamide Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)CCNC(=O)CN2C=CC3=CC=CC=C3C2=O

Isomeric SMILES

C1COCCN1CCCNC(=O)CCNC(=O)CN2C=CC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H28N4O4/c26-19(22-8-3-10-24-12-14-29-15-13-24)6-9-23-20(27)16-25-11-7-17-4-1-2-5-18(17)21(25)28/h1-2,4-5,7,11H,3,6,8-10,12-16H2,(H,22,26)(H,23,27)