(2S)-N-(4-cyanophenyl)-2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]propanamide

Systemtic Name: (2S)-N-(4-cyanophenyl)-2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]propanamide Openeye Name: (2S)-N-(4-cyanophenyl)-2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]propanamide CAS Name: (2S)-N-(4-cyanophenyl)-2-[(2R)-2-(4-methoxyphenyl)-1-pyrrolidin-1-iumyl]propanamide IUPAC Name: (2S)-N-(4-cyanophenyl)-2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]propanamide Traditional Name: (2S)-N-(4-cyanophenyl)-2-[(2R)-2-(4-methoxyphenyl)pyrrolidin-1-ium-1-yl]propionamide Formula: C21H24N3O2+ MolecularWeight: 350.43416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C#N)[NH+]2CCCC2C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)C#N)[NH+]2CCC[C@@H]2C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H23N3O2/c1-15(21(25)23-18-9-5-16(14-22)6-10-18)24-13-3-4-20(24)17-7-11-19(26-2)12-8-17/h5-12,15,20H,3-4,13H2,1-2H3,(H,23,25)/p+1/t15-,20+/m0/s1