1-(3,5-dimethylphenyl)-3-piperidin-1-ium-4-yl-urea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-piperidin-1-ium-4-yl-urea Openeye Name: 1-(3,5-dimethylphenyl)-3-piperidin-1-ium-4-yl-urea CAS Name: 1-(3,5-dimethylphenyl)-3-(4-piperidin-1-iumyl)urea IUPAC Name: 1-(3,5-dimethylphenyl)-3-piperidin-1-ium-4-ylurea Traditional Name: 1-(3,5-dimethylphenyl)-3-piperidin-1-ium-4-yl-urea Formula: C14H22N3O+ MolecularWeight: 248.34398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)NC2CC[NH2+]CC2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)NC2CC[NH2+]CC2)C

InChI

InChI=1S/C14H21N3O/c1-10-7-11(2)9-13(8-10)17-14(18)16-12-3-5-15-6-4-12/h7-9,12,15H,3-6H2,1-2H3,(H2,16,17,18)/p+1