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

Systemtic Name: 1-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-(4-propan-2-ylphenyl)urea Openeye Name: 1-(4-isopropylphenyl)-3-[(2-morpholinopyridin-1-ium-3-yl)methyl]urea CAS Name: 1-[[2-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-3-(4-propan-2-ylphenyl)urea IUPAC Name: 1-[(2-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-3-(4-propan-2-ylphenyl)urea Traditional Name: 1-[(2-morpholinopyridin-1-ium-3-yl)methyl]-3-p-cumenyl-urea Formula: C20H27N4O2+ MolecularWeight: 355.45398

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)NCC2=C([NH+]=CC=C2)N3CCOCC3

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)NCC2=C([NH+]=CC=C2)N3CCOCC3

InChI

InChI=1S/C20H26N4O2/c1-15(2)16-5-7-18(8-6-16)23-20(25)22-14-17-4-3-9-21-19(17)24-10-12-26-13-11-24/h3-9,15H,10-14H2,1-2H3,(H2,22,23,25)/p+1