[(1,2,2,6,6-pentamethyl-1,3-dihydropyridin-1-ium-4-yl)amino] benzoate

Systemtic Name: [(1,2,2,6,6-pentamethyl-1,3-dihydropyridin-1-ium-4-yl)amino] benzoate Openeye Name: [(1,2,2,6,6-pentamethyl-1,3-dihydropyridin-1-ium-4-yl)amino] benzoate CAS Name: benzoic acid [(1,2,2,6,6-pentamethyl-1,3-dihydropyridin-1-ium-4-yl)amino] ester IUPAC Name: [(1,2,2,6,6-pentamethyl-1,3-dihydropyridin-1-ium-4-yl)amino] benzoate Traditional Name: benzoic acid [(1,2,2,6,6-pentamethyl-1,3-dihydropyridin-1-ium-4-yl)amino] ester Formula: C17H25N2O2+ MolecularWeight: 289.3926

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC([NH+]1C)(C)C)NOC(=O)C2=CC=CC=C2)C

Isomeric SMILES

CC1(CC(=CC([NH+]1C)(C)C)NOC(=O)C2=CC=CC=C2)C

InChI

InChI=1S/C17H24N2O2/c1-16(2)11-14(12-17(3,4)19(16)5)18-21-15(20)13-9-7-6-8-10-13/h6-11,18H,12H2,1-5H3/p+1