(3,5-ditert-butyl-4-oxidanyl-phenyl)-(3-methylidene-4-oxidanylidene-1,3-oxazolidin-3-ium-2-yl)cyanamide; 2-hydroxyethyl(trimethyl)azanium

Systemtic Name: (3,5-ditert-butyl-4-oxidanyl-phenyl)-(3-methylidene-4-oxidanylidene-1,3-oxazolidin-3-ium-2-yl)cyanamide; 2-hydroxyethyl(trimethyl)azanium Openeye Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(3-methylene-4-oxo-oxazolidin-3-ium-2-yl)cyanamide; 2-hydroxyethyl(trimethyl)ammonium CAS Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(3-methylene-4-oxo-2-oxazolidin-3-iumyl)cyanamide; 2-hydroxyethyl(trimethyl)ammonium IUPAC Name: (3,5-ditert-butyl-4-hydroxyphenyl)-(3-methylidene-4-oxo-1,3-oxazolidin-3-ium-2-yl)cyanamide; 2-hydroxyethyl(trimethyl)azanium Traditional Name: (3,5-ditert-butyl-4-hydroxy-phenyl)-(4-keto-3-methylene-oxazolidin-3-ium-2-yl)cyanamide; 2-hydroxyethyl(trimethyl)ammonium Formula: C24H40N4O4+2 MolecularWeight: 448.5988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N(C#N)C2[N+](=C)C(=O)CO2.C[N+](C)(C)CCO

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N(C#N)C2[N+](=C)C(=O)CO2.C[N+](C)(C)CCO

InChI

InChI=1S/C19H25N3O3.C5H14NO/c1-18(2,3)13-8-12(9-14(16(13)24)19(4,5)6)22(11-20)17-21(7)15(23)10-25-17;1-6(2,3)4-5-7/h8-9,17H,7,10H2,1-6H3;7H,4-5H2,1-3H3/q;+1/p+1