5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]isoxazole-3-carboxamide CAS Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2R)-2-(4-morpholin-4-iumyl)-2-phenylethyl]-3-isoxazolecarboxamide IUPAC Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-phenylethyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2R)-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]isoxazole-3-carboxamide Formula: C24H26N3O5+ MolecularWeight: 436.48034

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(CNC(=O)C2=NOC(=C2)C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

Isomeric SMILES

C1COCC[NH+]1[C@@H](CNC(=O)C2=NOC(=C2)C3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

InChI

InChI=1S/C24H25N3O5/c28-24(25-16-20(17-4-2-1-3-5-17)27-8-10-29-11-9-27)19-15-22(32-26-19)18-6-7-21-23(14-18)31-13-12-30-21/h1-7,14-15,20H,8-13,16H2,(H,25,28)/p+1/t20-/m0/s1