1-(5-chloranyl-2-methoxy-phenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea

Systemtic Name: 1-(5-chloranyl-2-methoxy-phenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea Openeye Name: 1-(5-chloro-2-methoxy-phenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea CAS Name: 1-(5-chloro-2-methoxyphenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea IUPAC Name: 1-(5-chloro-2-methoxyphenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea Traditional Name: 1-(5-chloro-2-methoxy-phenyl)-3-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]urea Formula: C15H20ClN4O2+ MolecularWeight: 323.7979

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19ClN4O2/c1-9-12(10(2)20(3)19-9)8-17-15(21)18-13-7-11(16)5-6-14(13)22-4/h5-7,12H,8H2,1-4H3,(H-,17,18,21)/p+1