N-[2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]-2-oxidanylidene-ethyl]-4-phenoxy-benzamide

Systemtic Name: N-[2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]-2-oxidanylidene-ethyl]-4-phenoxy-benzamide Openeye Name: N-[2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]-2-oxo-ethyl]-4-phenoxy-benzamide CAS Name: N-[2-[methyl-(1-methyl-4-piperidin-1-iumyl)amino]-2-oxoethyl]-4-phenoxybenzamide IUPAC Name: N-[2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]-2-oxoethyl]-4-phenoxybenzamide Traditional Name: N-[2-keto-2-[methyl-(1-methylpiperidin-1-ium-4-yl)amino]ethyl]-4-phenoxy-benzamide Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)N(C)C(=O)CNC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCC(CC1)N(C)C(=O)CNC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3/c1-24-14-12-18(13-15-24)25(2)21(26)16-23-22(27)17-8-10-20(11-9-17)28-19-6-4-3-5-7-19/h3-11,18H,12-16H2,1-2H3,(H,23,27)/p+1