N-(2-methyl-1,3-benzoxazol-5-yl)-4-morpholin-4-yl-pyridin-1-ium-2-carboxamide

Systemtic Name: N-(2-methyl-1,3-benzoxazol-5-yl)-4-morpholin-4-yl-pyridin-1-ium-2-carboxamide Openeye Name: N-(2-methyl-1,3-benzoxazol-5-yl)-4-morpholino-pyridin-1-ium-2-carboxamide CAS Name: N-(2-methyl-1,3-benzoxazol-5-yl)-4-(4-morpholinyl)-2-pyridin-1-iumcarboxamide IUPAC Name: N-(2-methyl-1,3-benzoxazol-5-yl)-4-morpholin-4-ylpyridin-1-ium-2-carboxamide Traditional Name: N-(2-methyl-1,3-benzoxazol-5-yl)-4-morpholino-pyridin-1-ium-2-carboxamide Formula: C18H19N4O3+ MolecularWeight: 339.36846

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(O1)C=CC(=C2)NC(=O)C3=[NH+]C=CC(=C3)N4CCOCC4

Isomeric SMILES

CC1=NC2=C(O1)C=CC(=C2)NC(=O)C3=[NH+]C=CC(=C3)N4CCOCC4

InChI

InChI=1S/C18H18N4O3/c1-12-20-15-10-13(2-3-17(15)25-12)21-18(23)16-11-14(4-5-19-16)22-6-8-24-9-7-22/h2-5,10-11H,6-9H2,1H3,(H,21,23)/p+1