3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]propanamide

Systemtic Name: 3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]propanamide Openeye Name: 3-[5-(3,4-dimethylphenyl)oxazol-2-yl]-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]propanamide CAS Name: 3-[5-(3,4-dimethylphenyl)-2-oxazolyl]-N-[(2R)-2-phenyl-2-(1-pyrrolidin-1-iumyl)ethyl]propanamide IUPAC Name: 3-[5-(3,4-dimethylphenyl)-1,3-oxazol-2-yl]-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-ylethyl]propanamide Traditional Name: 3-[5-(3,4-dimethylphenyl)oxazol-2-yl]-N-[(2R)-2-phenyl-2-pyrrolidin-1-ium-1-yl-ethyl]propionamide Formula: C26H32N3O2+ MolecularWeight: 418.55118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CN=C(O2)CCC(=O)NCC(C3=CC=CC=C3)[NH+]4CCCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CN=C(O2)CCC(=O)NC[C@@H](C3=CC=CC=C3)[NH+]4CCCC4)C

InChI

InChI=1S/C26H31N3O2/c1-19-10-11-22(16-20(19)2)24-18-28-26(31-24)13-12-25(30)27-17-23(29-14-6-7-15-29)21-8-4-3-5-9-21/h3-5,8-11,16,18,23H,6-7,12-15,17H2,1-2H3,(H,27,30)/p+1/t23-/m0/s1