2-(2-cyanophenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]benzamide

Systemtic Name: 2-(2-cyanophenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]benzamide Openeye Name: 2-(2-cyanophenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]benzamide CAS Name: 2-(2-cyanophenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-(4-morpholin-4-iumyl)ethyl]benzamide IUPAC Name: 2-(2-cyanophenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-ylethyl]benzamide Traditional Name: 2-(2-cyanophenyl)-N-[(2R)-2-(4-methoxyphenyl)-2-morpholin-4-ium-4-yl-ethyl]benzamide Formula: C27H28N3O3+ MolecularWeight: 442.52952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=CC=C2C3=CC=CC=C3C#N)[NH+]4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=CC=CC=C2C3=CC=CC=C3C#N)[NH+]4CCOCC4

InChI

InChI=1S/C27H27N3O3/c1-32-22-12-10-20(11-13-22)26(30-14-16-33-17-15-30)19-29-27(31)25-9-5-4-8-24(25)23-7-3-2-6-21(23)18-28/h2-13,26H,14-17,19H2,1H3,(H,29,31)/p+1/t26-/m0/s1