1-[(3-methylphenyl)methyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea

Systemtic Name: 1-[(3-methylphenyl)methyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea Openeye Name: 1-(m-tolylmethyl)-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea CAS Name: 1-[(3-methylphenyl)methyl]-3-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)urea IUPAC Name: 1-[(3-methylphenyl)methyl]-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea Traditional Name: 1-(3-methylbenzyl)-3-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)urea Formula: C18H30N3O+ MolecularWeight: 304.4503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)NC2CC([NH2+]C(C2)(C)C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)NC2CC([NH2+]C(C2)(C)C)(C)C

InChI

InChI=1S/C18H29N3O/c1-13-7-6-8-14(9-13)12-19-16(22)20-15-10-17(2,3)21-18(4,5)11-15/h6-9,15,21H,10-12H2,1-5H3,(H2,19,20,22)/p+1