3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]propanamide Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]propanamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]propanamide IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]propanamide Traditional Name: N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-3-phthalimido-propionamide Formula: C21H23N4O4+ MolecularWeight: 395.43172

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H22N4O4/c26-19(7-8-25-20(27)16-3-1-2-4-17(16)21(25)28)23-14-15-5-6-18(22-13-15)24-9-11-29-12-10-24/h1-6,13H,7-12,14H2,(H,23,26)/p+1