4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]benzamide

Systemtic Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-yl-ethyl]benzamide Openeye Name: 4-[(3,5-dimethylisoxazol-4-yl)methoxy]-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-isoxazolyl)methoxy]-N-[(2R)-2-(1-pyrrolidin-1-iumyl)-2-thiophen-2-ylethyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-thiophen-2-ylethyl]benzamide Traditional Name: 4-[(3,5-dimethylisoxazol-4-yl)methoxy]-N-[(2R)-2-pyrrolidin-1-ium-1-yl-2-(2-thienyl)ethyl]benzamide Formula: C23H28N3O3S+ MolecularWeight: 426.55172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC2=CC=C(C=C2)C(=O)NCC(C3=CC=CS3)[NH+]4CCCC4

Isomeric SMILES

CC1=C(C(=NO1)C)COC2=CC=C(C=C2)C(=O)NC[C@H](C3=CC=CS3)[NH+]4CCCC4

InChI

InChI=1S/C23H27N3O3S/c1-16-20(17(2)29-25-16)15-28-19-9-7-18(8-10-19)23(27)24-14-21(22-6-5-13-30-22)26-11-3-4-12-26/h5-10,13,21H,3-4,11-12,14-15H2,1-2H3,(H,24,27)/p+1/t21-/m1/s1