2-(4-bromophenyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]ethanamide

Systemtic Name: 2-(4-bromophenyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]ethanamide Openeye Name: 2-(4-bromophenyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]acetamide CAS Name: 2-(4-bromophenyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]acetamide IUPAC Name: 2-(4-bromophenyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]acetamide Traditional Name: 2-(4-bromophenyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]acetamide Formula: C15H19BrN3O+ MolecularWeight: 337.23486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=N[N+](=C(C1CNC(=O)CC2=CC=C(C=C2)Br)C)C

Isomeric SMILES

CC1=N[N+](=C(C1CNC(=O)CC2=CC=C(C=C2)Br)C)C

InChI

InChI=1S/C15H18BrN3O/c1-10-14(11(2)19(3)18-10)9-17-15(20)8-12-4-6-13(16)7-5-12/h4-7,14H,8-9H2,1-3H3/p+1