1-phenyl-3-[(3S)-piperidin-1-ium-3-yl]urea

Systemtic Name: 1-phenyl-3-[(3S)-piperidin-1-ium-3-yl]urea Openeye Name: 1-phenyl-3-[(3S)-piperidin-1-ium-3-yl]urea CAS Name: 1-phenyl-3-[(3S)-3-piperidin-1-iumyl]urea IUPAC Name: 1-phenyl-3-[(3S)-piperidin-1-ium-3-yl]urea Traditional Name: 1-phenyl-3-[(3S)-piperidin-1-ium-3-yl]urea Formula: C12H18N3O+ MolecularWeight: 220.29082

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH2+]C1)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

C1C[C@@H](C[NH2+]C1)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C12H17N3O/c16-12(14-10-5-2-1-3-6-10)15-11-7-4-8-13-9-11/h1-3,5-6,11,13H,4,7-9H2,(H2,14,15,16)/p+1/t11-/m0/s1