N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]-2-phenoxy-benzamide

Systemtic Name: N-[1-(2-oxidanylidene-2-phenylazanyl-ethyl)piperidin-1-ium-4-yl]-2-phenoxy-benzamide Openeye Name: N-[1-(2-anilino-2-oxo-ethyl)piperidin-1-ium-4-yl]-2-phenoxy-benzamide CAS Name: N-[1-(2-anilino-2-oxoethyl)-4-piperidin-1-iumyl]-2-phenoxybenzamide IUPAC Name: N-[1-(2-anilino-2-oxoethyl)piperidin-1-ium-4-yl]-2-phenoxybenzamide Traditional Name: N-[1-(2-anilino-2-keto-ethyl)piperidin-1-ium-4-yl]-2-phenoxy-benzamide Formula: C26H28N3O3+ MolecularWeight: 430.51882

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC(=O)C2=CC=CC=C2OC3=CC=CC=C3)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC(=O)C2=CC=CC=C2OC3=CC=CC=C3)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O3/c30-25(27-20-9-3-1-4-10-20)19-29-17-15-21(16-18-29)28-26(31)23-13-7-8-14-24(23)32-22-11-5-2-6-12-22/h1-14,21H,15-19H2,(H,27,30)(H,28,31)/p+1