N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-2-propan-2-yl-1,3-benzoxazole-5-carboxamide

Systemtic Name: N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-2-propan-2-yl-1,3-benzoxazole-5-carboxamide Openeye Name: 2-isopropyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1,3-benzoxazole-5-carboxamide CAS Name: N-[2-methyl-2-(4-morpholin-4-iumyl)propyl]-2-propan-2-yl-1,3-benzoxazole-5-carboxamide IUPAC Name: N-(2-methyl-2-morpholin-4-ium-4-ylpropyl)-2-propan-2-yl-1,3-benzoxazole-5-carboxamide Traditional Name: 2-isopropyl-N-(2-methyl-2-morpholin-4-ium-4-yl-propyl)-1,3-benzoxazole-5-carboxamide Formula: C19H28N3O3+ MolecularWeight: 346.44392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)NCC(C)(C)[NH+]3CCOCC3

Isomeric SMILES

CC(C)C1=NC2=C(O1)C=CC(=C2)C(=O)NCC(C)(C)[NH+]3CCOCC3

InChI

InChI=1S/C19H27N3O3/c1-13(2)18-21-15-11-14(5-6-16(15)25-18)17(23)20-12-19(3,4)22-7-9-24-10-8-22/h5-6,11,13H,7-10,12H2,1-4H3,(H,20,23)/p+1