N-(3-chloranyl-4-methyl-phenyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-4-methyl-phenyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]ethanamide Openeye Name: N-(3-chloro-4-methyl-phenyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide CAS Name: N-(3-chloro-4-methylphenyl)-2-[(2S)-2-phenyl-1-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-(3-chloro-4-methylphenyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide Traditional Name: N-(3-chloro-4-methyl-phenyl)-2-[(2S)-2-phenylpyrrolidin-1-ium-1-yl]acetamide Formula: C19H22ClN2O+ MolecularWeight: 329.84378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21ClN2O/c1-14-9-10-16(12-17(14)20)21-19(23)13-22-11-5-8-18(22)15-6-3-2-4-7-15/h2-4,6-7,9-10,12,18H,5,8,11,13H2,1H3,(H,21,23)/p+1/t18-/m0/s1