(2S)-N-(2,4-dichlorophenyl)-1-[(5-ethanoyl-2-methoxy-phenyl)methyl]pyrrolidin-1-ium-2-carboxamide

Systemtic Name: (2S)-N-(2,4-dichlorophenyl)-1-[(5-ethanoyl-2-methoxy-phenyl)methyl]pyrrolidin-1-ium-2-carboxamide Openeye Name: (2S)-1-[(5-acetyl-2-methoxy-phenyl)methyl]-N-(2,4-dichlorophenyl)pyrrolidin-1-ium-2-carboxamide CAS Name: (2S)-1-[(5-acetyl-2-methoxyphenyl)methyl]-N-(2,4-dichlorophenyl)-2-pyrrolidin-1-iumcarboxamide IUPAC Name: (2S)-1-[(5-acetyl-2-methoxyphenyl)methyl]-N-(2,4-dichlorophenyl)pyrrolidin-1-ium-2-carboxamide Traditional Name: (2S)-1-(5-acetyl-2-methoxy-benzyl)-N-(2,4-dichlorophenyl)pyrrolidin-1-ium-2-carboxamide Formula: C21H23Cl2N2O3+ MolecularWeight: 422.32492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)C[NH+]2CCCC2C(=O)NC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)C[NH+]2CCC[C@H]2C(=O)NC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H22Cl2N2O3/c1-13(26)14-5-8-20(28-2)15(10-14)12-25-9-3-4-19(25)21(27)24-18-7-6-16(22)11-17(18)23/h5-8,10-11,19H,3-4,9,12H2,1-2H3,(H,24,27)/p+1/t19-/m0/s1