N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-(1,3-thiazol-4-ylmethoxy)benzamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-3-(1,3-thiazol-4-ylmethoxy)benzamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(thiazol-4-ylmethoxy)benzamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-(4-thiazolylmethoxy)benzamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(1,3-thiazol-4-ylmethoxy)benzamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-3-(thiazol-4-ylmethoxy)benzamide Formula: C23H26N3O2S+ MolecularWeight: 408.53644

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC(=CC=C2)OCC3=CSC=N3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC(=CC=C2)OCC3=CSC=N3)CC4=CC=CC=C4

InChI

InChI=1S/C23H25N3O2S/c27-23(19-7-4-8-22(13-19)28-15-21-16-29-17-24-21)25-20-9-11-26(12-10-20)14-18-5-2-1-3-6-18/h1-8,13,16-17,20H,9-12,14-15H2,(H,25,27)/p+1