3-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-2,1-benzoxazole-5-carboxamide

Systemtic Name: 3-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-2,1-benzoxazole-5-carboxamide Openeye Name: 3-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-2,1-benzoxazole-5-carboxamide CAS Name: 3-phenyl-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)-2,1-benzoxazole-5-carboxamide IUPAC Name: 3-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)-2,1-benzoxazole-5-carboxamide Traditional Name: 3-phenyl-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)anthranil-5-carboxamide Formula: C23H28N3O2+ MolecularWeight: 378.48732

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)NC(=O)C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C

InChI

InChI=1S/C23H27N3O2/c1-22(2)13-17(14-23(3,4)26-22)24-21(27)16-10-11-19-18(12-16)20(28-25-19)15-8-6-5-7-9-15/h5-12,17,26H,13-14H2,1-4H3,(H,24,27)/p+1