3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-morpholin-4-ylphenyl)propanamide

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(4-morpholin-4-ylphenyl)propanamide Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-(4-morpholinophenyl)propanamide CAS Name: 3-(5-bromo-1,3-dioxo-2-isoindolyl)-N-[4-(4-morpholinyl)phenyl]propanamide IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)-N-(4-morpholin-4-ylphenyl)propanamide Traditional Name: 3-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-(4-morpholinophenyl)propionamide Formula: C21H20BrN3O4 MolecularWeight: 458.3052

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)CCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)CCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H20BrN3O4/c22-14-1-6-17-18(13-14)21(28)25(20(17)27)8-7-19(26)23-15-2-4-16(5-3-15)24-9-11-29-12-10-24/h1-6,13H,7-12H2,(H,23,26)