N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-(2-oxidanylidenepyrrolidin-1-yl)benzamide

Systemtic Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-(2-oxidanylidenepyrrolidin-1-yl)benzamide Openeye Name: N-[(6-morpholinopyridin-1-ium-3-yl)methyl]-3-(2-oxopyrrolidin-1-yl)benzamide CAS Name: N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-3-(2-oxo-1-pyrrolidinyl)benzamide IUPAC Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-(2-oxopyrrolidin-1-yl)benzamide Traditional Name: 3-(2-ketopyrrolidino)-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzamide Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC(=C2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC(=C2)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

InChI

InChI=1S/C21H24N4O3/c26-20-5-2-8-25(20)18-4-1-3-17(13-18)21(27)23-15-16-6-7-19(22-14-16)24-9-11-28-12-10-24/h1,3-4,6-7,13-14H,2,5,8-12,15H2,(H,23,27)/p+1