N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide

Systemtic Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide Openeye Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(thiazol-4-ylmethoxy)benzamide CAS Name: N-[(2R)-2-(2-chlorophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-(4-thiazolylmethoxy)benzamide IUPAC Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide Traditional Name: N-[(2R)-2-(2-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(thiazol-4-ylmethoxy)benzamide Formula: C23H25ClN3O2S+ MolecularWeight: 442.9815

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=CC=C(C=C2)OCC3=CSC=N3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=CC=C(C=C2)OCC3=CSC=N3)C4=CC=CC=C4Cl

InChI

InChI=1S/C23H24ClN3O2S/c24-21-6-2-1-5-20(21)22(27-11-3-4-12-27)13-25-23(28)17-7-9-19(10-8-17)29-14-18-15-30-16-26-18/h1-2,5-10,15-16,22H,3-4,11-14H2,(H,25,28)/p+1/t22-/m0/s1