1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea

Systemtic Name: 1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea Openeye Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea CAS Name: 1-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]-3-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)urea IUPAC Name: 1-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea Traditional Name: 1-[1-(3-isopropenylphenyl)-1-methyl-ethyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea Formula: C22H36N3O+ MolecularWeight: 358.54074

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NC2CC([NH2+]C(C2)(C)C)(C)C

Isomeric SMILES

CC(=C)C1=CC(=CC=C1)C(C)(C)NC(=O)NC2CC([NH2+]C(C2)(C)C)(C)C

InChI

InChI=1S/C22H35N3O/c1-15(2)16-10-9-11-17(12-16)22(7,8)24-19(26)23-18-13-20(3,4)25-21(5,6)14-18/h9-12,18,25H,1,13-14H2,2-8H3,(H2,23,24,26)/p+1