N-(2,5-dimethylphenyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,5-dimethylphenyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(2,5-dimethylphenyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(2,5-dimethylphenyl)-2-[(2S)-2-phenyl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(2,5-dimethylphenyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(2,5-dimethylphenyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide Formula: C20H25N2O+ MolecularWeight: 309.4253

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C[NH+]2CCCC2C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C[NH+]2CCC[C@H]2C3=CC=CC=C3

InChI

InChI=1S/C20H24N2O/c1-15-10-11-16(2)18(13-15)21-20(23)14-22-12-6-9-19(22)17-7-4-3-5-8-17/h3-5,7-8,10-11,13,19H,6,9,12,14H2,1-2H3,(H,21,23)/p+1/t19-/m0/s1