1-(3-methylphenyl)-3-[[(3R)-piperidin-1-ium-3-yl]methyl]urea

Systemtic Name: 1-(3-methylphenyl)-3-[[(3R)-piperidin-1-ium-3-yl]methyl]urea Openeye Name: 1-(m-tolyl)-3-[[(3R)-piperidin-1-ium-3-yl]methyl]urea CAS Name: 1-(3-methylphenyl)-3-[[(3R)-3-piperidin-1-iumyl]methyl]urea IUPAC Name: 1-(3-methylphenyl)-3-[[(3R)-piperidin-1-ium-3-yl]methyl]urea Traditional Name: 1-(m-tolyl)-3-[[(3R)-piperidin-1-ium-3-yl]methyl]urea Formula: C14H22N3O+ MolecularWeight: 248.34398

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NCC2CCC[NH2+]C2

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC[C@H]2CCC[NH2+]C2

InChI

InChI=1S/C14H21N3O/c1-11-4-2-6-13(8-11)17-14(18)16-10-12-5-3-7-15-9-12/h2,4,6,8,12,15H,3,5,7,9-10H2,1H3,(H2,16,17,18)/p+1/t12-/m0/s1