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

Systemtic Name: N-[(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-methoxy-benzamide Openeye Name: N-[(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-methoxy-benzamide CAS Name: N-[(2R)-2-(4-ethylphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2-methoxybenzamide IUPAC Name: N-[(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ium-1-ylethyl]-2-methoxybenzamide Traditional Name: N-[(2R)-2-(4-ethylphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-2-methoxy-benzamide Formula: C22H29N2O2+ MolecularWeight: 353.47786

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(CNC(=O)C2=CC=CC=C2OC)[NH+]3CCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](CNC(=O)C2=CC=CC=C2OC)[NH+]3CCCC3

InChI

InChI=1S/C22H28N2O2/c1-3-17-10-12-18(13-11-17)20(24-14-6-7-15-24)16-23-22(25)19-8-4-5-9-21(19)26-2/h4-5,8-13,20H,3,6-7,14-16H2,1-2H3,(H,23,25)/p+1/t20-/m0/s1