4-(3,5-dimethylpyrazol-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)benzamide

Systemtic Name: 4-(3,5-dimethylpyrazol-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Openeye Name: 4-(3,5-dimethylpyrazol-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)benzamide CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)-N-[3-(4-morpholin-4-iumyl)propyl]benzamide IUPAC Name: 4-(3,5-dimethylpyrazol-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Traditional Name: 4-(3,5-dimethylpyrazol-1-yl)-N-(3-morpholin-4-ium-4-ylpropyl)benzamide Formula: C19H27N4O2+ MolecularWeight: 343.44328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)NCCC[NH+]3CCOCC3)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)C(=O)NCCC[NH+]3CCOCC3)C

InChI

InChI=1S/C19H26N4O2/c1-15-14-16(2)23(21-15)18-6-4-17(5-7-18)19(24)20-8-3-9-22-10-12-25-13-11-22/h4-7,14H,3,8-13H2,1-2H3,(H,20,24)/p+1