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

Systemtic Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(3-hydroxyphenyl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(3-hydroxyphenyl)methyl]piperidin-1-ium-4-carboxamide CAS Name: N-[4-(3,5-dimethyl-1-pyrazolyl)phenyl]-1-[(3-hydroxyphenyl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-[(3-hydroxyphenyl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-[4-(3,5-dimethylpyrazol-1-yl)phenyl]-1-(3-hydroxybenzyl)piperidin-1-ium-4-carboxamide Formula: C24H29N4O2+ MolecularWeight: 405.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)NC(=O)C3CC[NH+](CC3)CC4=CC(=CC=C4)O)C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)NC(=O)C3CC[NH+](CC3)CC4=CC(=CC=C4)O)C

InChI

InChI=1S/C24H28N4O2/c1-17-14-18(2)28(26-17)22-8-6-21(7-9-22)25-24(30)20-10-12-27(13-11-20)16-19-4-3-5-23(29)15-19/h3-9,14-15,20,29H,10-13,16H2,1-2H3,(H,25,30)/p+1