3-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]propanamide

Systemtic Name: 3-[2-(1-oxidanylideneisoquinolin-2-yl)ethanoylamino]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]propanamide Openeye Name: 3-[[2-(1-oxo-2-isoquinolyl)acetyl]amino]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide CAS Name: 3-[[1-oxo-2-(1-oxo-2-isoquinolinyl)ethyl]amino]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]propanamide IUPAC Name: 3-[[2-(1-oxoisoquinolin-2-yl)acetyl]amino]-N-[3-(2-oxopyrrolidin-1-yl)propyl]propanamide Traditional Name: 3-[[2-(1-keto-2-isoquinolyl)acetyl]amino]-N-[3-(2-ketopyrrolidino)propyl]propionamide Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC(=O)CCNC(=O)CN2C=CC3=CC=CC=C3C2=O

Isomeric SMILES

C1CC(=O)N(C1)CCCNC(=O)CCNC(=O)CN2C=CC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H26N4O4/c26-18(22-10-4-13-24-12-3-7-20(24)28)8-11-23-19(27)15-25-14-9-16-5-1-2-6-17(16)21(25)29/h1-2,5-6,9,14H,3-4,7-8,10-13,15H2,(H,22,26)(H,23,27)