N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-1-[(6-methyl-2-pyridinyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-carboxamide Formula: C24H30N5O+ MolecularWeight: 404.5279

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)N4C(=CC(=N4)C)C

Isomeric SMILES

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)C(=O)NC3=CC=C(C=C3)N4C(=CC(=N4)C)C

InChI

InChI=1S/C24H29N5O/c1-17-5-4-6-22(25-17)16-28-13-11-20(12-14-28)24(30)26-21-7-9-23(10-8-21)29-19(3)15-18(2)27-29/h4-10,15,20H,11-14,16H2,1-3H3,(H,26,30)/p+1