N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-1,3-diphenyl-pyrazole-4-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-1,3-diphenyl-pyrazole-4-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-1,3-diphenyl-pyrazole-4-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-1,3-diphenyl-4-pyrazolecarboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-1,3-diphenylpyrazole-4-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-1,3-diphenyl-pyrazole-4-carboxamide Formula: C23H26N5O2+ MolecularWeight: 404.48484

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4)CC(=O)N

InChI

InChI=1S/C23H25N5O2/c24-21(29)16-27-13-11-18(12-14-27)25-23(30)20-15-28(19-9-5-2-6-10-19)26-22(20)17-7-3-1-4-8-17/h1-10,15,18H,11-14,16H2,(H2,24,29)(H,25,30)/p+1