1-(2,3-dimethylphenyl)-3-(1-propan-2-ylpiperidin-1-ium-4-yl)urea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-(1-propan-2-ylpiperidin-1-ium-4-yl)urea Openeye Name: 1-(2,3-dimethylphenyl)-3-(1-isopropylpiperidin-1-ium-4-yl)urea CAS Name: 1-(2,3-dimethylphenyl)-3-(1-propan-2-yl-4-piperidin-1-iumyl)urea IUPAC Name: 1-(2,3-dimethylphenyl)-3-(1-propan-2-ylpiperidin-1-ium-4-yl)urea Traditional Name: 1-(2,3-dimethylphenyl)-3-(1-isopropylpiperidin-1-ium-4-yl)urea Formula: C17H28N3O+ MolecularWeight: 290.42372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)NC2CC[NH+](CC2)C(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)NC2CC[NH+](CC2)C(C)C)C

InChI

InChI=1S/C17H27N3O/c1-12(2)20-10-8-15(9-11-20)18-17(21)19-16-7-5-6-13(3)14(16)4/h5-7,12,15H,8-11H2,1-4H3,(H2,18,19,21)/p+1