3-ethoxy-N-[(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide

Systemtic Name: 3-ethoxy-N-[(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Openeye Name: 3-ethoxy-N-[(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 3-ethoxy-N-[(2R)-2-(4-ethylphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 3-ethoxy-N-[(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 3-ethoxy-N-[(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C23H31N2O2+ MolecularWeight: 367.50444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC(=O)C2=CC(=CC=C2)OCC)[NH+]3CCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CNC(=O)C2=CC(=CC=C2)OCC)[NH+]3CCCC3

InChI

InChI=1S/C23H30N2O2/c1-3-18-10-12-19(13-11-18)22(25-14-5-6-15-25)17-24-23(26)20-8-7-9-21(16-20)27-4-2/h7-13,16,22H,3-6,14-15,17H2,1-2H3,(H,24,26)/p+1/t22-/m0/s1