[(5R)-1-tert-butyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]methylidene-phenethyl-azanium

Systemtic Name: [(5R)-1-tert-butyl-2,4,6-tris(oxidanylidene)-1,3-diazinan-5-yl]methylidene-phenethyl-azanium Openeye Name: [(5R)-1-tert-butyl-2,4,6-trioxo-hexahydropyrimidin-5-yl]methylene-phenethyl-ammonium CAS Name: [(5R)-1-tert-butyl-2,4,6-trioxo-1,3-diazinan-5-yl]methylidene-phenethylammonium IUPAC Name: [(5R)-1-tert-butyl-2,4,6-trioxo-1,3-diazinan-5-yl]methylidene-phenethylazanium Traditional Name: [(5R)-1-tert-butyl-2,4,6-triketo-hexahydropyrimidin-5-yl]methylene-phenethyl-ammonium Formula: C17H22N3O3+ MolecularWeight: 316.37488

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(C(=O)NC1=O)C=[NH+]CCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)N1C(=O)[C@@H](C(=O)NC1=O)C=[NH+]CCC2=CC=CC=C2

InChI

InChI=1S/C17H21N3O3/c1-17(2,3)20-15(22)13(14(21)19-16(20)23)11-18-10-9-12-7-5-4-6-8-12/h4-8,11,13H,9-10H2,1-3H3,(H,19,21,23)/p+1/t13-/m1/s1