N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4-(pyrazol-1-ylmethyl)benzamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-4-(pyrazol-1-ylmethyl)benzamide Formula: C23H27N4O+ MolecularWeight: 375.48668

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC=C(C=C2)CN3C=CC=N3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC=C(C=C2)CN3C=CC=N3)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O/c28-23(21-9-7-20(8-10-21)18-27-14-4-13-24-27)25-22-11-15-26(16-12-22)17-19-5-2-1-3-6-19/h1-10,13-14,22H,11-12,15-18H2,(H,25,28)/p+1