1-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-[(1-phenylcyclopropyl)methyl]urea

Systemtic Name: 1-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-[(1-phenylcyclopropyl)methyl]urea Openeye Name: 1-[(2-morpholinopyridin-1-ium-3-yl)methyl]-3-[(1-phenylcyclopropyl)methyl]urea CAS Name: 1-[[2-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-3-[(1-phenylcyclopropyl)methyl]urea IUPAC Name: 1-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-[(1-phenylcyclopropyl)methyl]urea Traditional Name: 1-[(2-morpholinopyridin-1-ium-3-yl)methyl]-3-[(1-phenylcyclopropyl)methyl]urea Formula: C21H27N4O2+ MolecularWeight: 367.46468

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1(CNC(=O)NCC2=C([NH+]=CC=C2)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

C1CC1(CNC(=O)NCC2=C([NH+]=CC=C2)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C21H26N4O2/c26-20(24-16-21(8-9-21)18-6-2-1-3-7-18)23-15-17-5-4-10-22-19(17)25-11-13-27-14-12-25/h1-7,10H,8-9,11-16H2,(H2,23,24,26)/p+1