1-methyl-3-(3-methylphenyl)-1-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]urea

Systemtic Name: 1-methyl-3-(3-methylphenyl)-1-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]urea Openeye Name: 1-methyl-3-(m-tolyl)-1-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]urea CAS Name: 1-methyl-3-(3-methylphenyl)-1-[2-[(2R)-2-piperidin-1-iumyl]ethyl]urea IUPAC Name: 1-methyl-3-(3-methylphenyl)-1-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]urea Traditional Name: 1-methyl-3-(m-tolyl)-1-[2-[(2R)-piperidin-1-ium-2-yl]ethyl]urea Formula: C16H26N3O+ MolecularWeight: 276.39714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N(C)CCC2CCCC[NH2+]2

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O/c1-13-6-5-8-15(12-13)18-16(20)19(2)11-9-14-7-3-4-10-17-14/h5-6,8,12,14,17H,3-4,7,9-11H2,1-2H3,(H,18,20)/p+1/t14-/m1/s1