4-(aminomethyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide

Systemtic Name: 4-(aminomethyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide Openeye Name: 4-(aminomethyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide CAS Name: 4-(aminomethyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide IUPAC Name: 4-(aminomethyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide Traditional Name: 4-(aminomethyl)-N-[(1,3,5-trimethyl-4H-pyrazol-1-ium-4-yl)methyl]benzamide Formula: C15H21N4O+ MolecularWeight: 273.35344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N4O/c1-10-14(11(2)19(3)18-10)9-17-15(20)13-6-4-12(8-16)5-7-13/h4-7,14H,8-9,16H2,1-3H3/p+1