1-(4-chlorophenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea

Systemtic Name: 1-(4-chlorophenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea Openeye Name: 1-(4-chlorophenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea CAS Name: 1-(4-chlorophenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea IUPAC Name: 1-(4-chlorophenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea Traditional Name: 1-(4-chlorophenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea Formula: C14H18ClN4O+ MolecularWeight: 293.77192

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Descriptors Computed from Structure

Canonical SMILES:

CC1=N[N+](=C(C1CNC(=O)NC2=CC=C(C=C2)Cl)C)C

Isomeric SMILES

CC1=N[N+](=C(C1CNC(=O)NC2=CC=C(C=C2)Cl)C)C

InChI

InChI=1S/C14H17ClN4O/c1-9-13(10(2)19(3)18-9)8-16-14(20)17-12-6-4-11(15)5-7-12/h4-7,13H,8H2,1-3H3,(H-,16,17,20)/p+1