1-phenyl-3-(pyridin-1-ium-3-ylmethyl)urea

Systemtic Name: 1-phenyl-3-(pyridin-1-ium-3-ylmethyl)urea Openeye Name: 1-phenyl-3-(pyridin-1-ium-3-ylmethyl)urea CAS Name: 1-phenyl-3-(3-pyridin-1-iumylmethyl)urea IUPAC Name: 1-phenyl-3-(pyridin-1-ium-3-ylmethyl)urea Traditional Name: 1-phenyl-3-(pyridin-1-ium-3-ylmethyl)urea Formula: C13H14N3O+ MolecularWeight: 228.26976

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NCC2=C[NH+]=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NCC2=C[NH+]=CC=C2

InChI

InChI=1S/C13H13N3O/c17-13(16-12-6-2-1-3-7-12)15-10-11-5-4-8-14-9-11/h1-9H,10H2,(H2,15,16,17)/p+1