N-[(2R)-2-(4-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-5-phenyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[(2R)-2-(4-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-5-phenyl-1,2-oxazole-3-carboxamide Openeye Name: N-[(2R)-2-(4-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-5-phenyl-isoxazole-3-carboxamide CAS Name: N-[(2R)-2-(4-chlorophenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-5-phenyl-3-isoxazolecarboxamide IUPAC Name: N-[(2R)-2-(4-chlorophenyl)-2-pyrrolidin-1-ium-1-ylethyl]-5-phenyl-1,2-oxazole-3-carboxamide Traditional Name: N-[(2R)-2-(4-chlorophenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-5-phenyl-isoxazole-3-carboxamide Formula: C22H23ClN3O2+ MolecularWeight: 396.88992

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=NOC(=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=NOC(=C2)C3=CC=CC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O2/c23-18-10-8-16(9-11-18)20(26-12-4-5-13-26)15-24-22(27)19-14-21(28-25-19)17-6-2-1-3-7-17/h1-3,6-11,14,20H,4-5,12-13,15H2,(H,24,27)/p+1/t20-/m0/s1