2-[4-(1,3-benzoxazol-2-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]ethanamide

Systemtic Name: 2-[4-(1,3-benzoxazol-2-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]ethanamide Openeye Name: 2-[4-(1,3-benzoxazol-2-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]acetamide CAS Name: 2-[4-(1,3-benzoxazol-2-yl)-2-(4-morpholin-4-iumylmethyl)phenoxy]acetamide IUPAC Name: 2-[4-(1,3-benzoxazol-2-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]acetamide Traditional Name: 2-[4-(1,3-benzoxazol-2-yl)-2-(morpholin-4-ium-4-ylmethyl)phenoxy]acetamide Formula: C20H22N3O4+ MolecularWeight: 368.40638

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=C(C=CC(=C2)C3=NC4=CC=CC=C4O3)OCC(=O)N

Isomeric SMILES

C1COCC[NH+]1CC2=C(C=CC(=C2)C3=NC4=CC=CC=C4O3)OCC(=O)N

InChI

InChI=1S/C20H21N3O4/c21-19(24)13-26-17-6-5-14(11-15(17)12-23-7-9-25-10-8-23)20-22-16-3-1-2-4-18(16)27-20/h1-6,11H,7-10,12-13H2,(H2,21,24)/p+1