2-(4-cyano-2-ethoxy-phenoxy)-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide

Systemtic Name: 2-(4-cyano-2-ethoxy-phenoxy)-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]ethanamide Openeye Name: 2-(4-cyano-2-ethoxy-phenoxy)-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]acetamide CAS Name: 2-(4-cyano-2-ethoxyphenoxy)-N-[(2R)-2-(4-methoxyphenyl)-2-(1-piperidin-1-iumyl)ethyl]acetamide IUPAC Name: 2-(4-cyano-2-ethoxyphenoxy)-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-ylethyl]acetamide Traditional Name: 2-(4-cyano-2-ethoxy-phenoxy)-N-[(2R)-2-(4-methoxyphenyl)-2-piperidin-1-ium-1-yl-ethyl]acetamide Formula: C25H32N3O4+ MolecularWeight: 438.53928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC(=O)NCC(C2=CC=C(C=C2)OC)[NH+]3CCCCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC(=O)NC[C@@H](C2=CC=C(C=C2)OC)[NH+]3CCCCC3

InChI

InChI=1S/C25H31N3O4/c1-3-31-24-15-19(16-26)7-12-23(24)32-18-25(29)27-17-22(28-13-5-4-6-14-28)20-8-10-21(30-2)11-9-20/h7-12,15,22H,3-6,13-14,17-18H2,1-2H3,(H,27,29)/p+1/t22-/m0/s1