1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea

Systemtic Name: 1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Openeye Name: 3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea CAS Name: 1-methyl-3-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]-1-(1-methyl-4-piperidin-1-iumyl)urea IUPAC Name: 1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]urea Traditional Name: 3-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea Formula: C20H32N3O+ MolecularWeight: 330.48758

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)N(C)C2CC[NH+](CC2)C

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)N(C)C2CC[NH+](CC2)C

InChI

InChI=1S/C20H31N3O/c1-15(2)16-8-7-9-17(14-16)20(3,4)21-19(24)23(6)18-10-12-22(5)13-11-18/h7-9,14,18H,1,10-13H2,2-6H3,(H,21,24)/p+1