(5-methyl-1-phenyl-pyrazol-4-yl)-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]methanone

Systemtic Name: (5-methyl-1-phenyl-pyrazol-4-yl)-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]methanone Openeye Name: [2-(isopropylamino)pyridin-1-ium-1-yl]-(5-methyl-1-phenyl-pyrazol-4-yl)methanone CAS Name: (5-methyl-1-phenyl-4-pyrazolyl)-[2-(propan-2-ylamino)-1-pyridin-1-iumyl]methanone IUPAC Name: (5-methyl-1-phenylpyrazol-4-yl)-[2-(propan-2-ylamino)pyridin-1-ium-1-yl]methanone Traditional Name: [2-(isopropylamino)pyridin-1-ium-1-yl]-(5-methyl-1-phenyl-pyrazol-4-yl)methanone Formula: C19H21N4O+ MolecularWeight: 321.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)[N+]3=CC=CC=C3NC(C)C

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)[N+]3=CC=CC=C3NC(C)C

InChI

InChI=1S/C19H20N4O/c1-14(2)21-18-11-7-8-12-22(18)19(24)17-13-20-23(15(17)3)16-9-5-4-6-10-16/h4-14H,1-3H3/p+1