4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)cubane-1-carboxylic acid

Systemtic Name: 4-(2-azanyl-3-oxidanyl-3-oxidanylidene-propyl)cubane-1-carboxylic acid Openeye Name: 4-(2-amino-3-hydroxy-3-oxo-propyl)cubane-1-carboxylic acid CAS Name: 4-(2-amino-3-hydroxy-3-oxopropyl)-1-cubanecarboxylic acid IUPAC Name: 4-(2-amino-3-hydroxy-3-oxopropyl)cubane-1-carboxylic acid Traditional Name: 4-(2-amino-3-hydroxy-3-keto-propyl)cubane-1-carboxylic acid Formula: C12H13NO4 MolecularWeight: 235.23592

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)O)N)C12C3C4C1C5C2C3C45C(=O)O

Isomeric SMILES

C(C(C(=O)O)N)C12C3C4C1C5C2C3C45C(=O)O

InChI

InChI=1S/C12H13NO4/c13-2(9(14)15)1-11-3-6-4(11)8-5(11)7(3)12(6,8)10(16)17/h2-8H,1,13H2,(H,14,15)(H,16,17)