(3S,4S,5R)-4-acetamido-3-azido-5-(hydroxymethyl)cyclohexene-1-carboxylic acid

Systemtic Name: (3S,4S,5R)-4-acetamido-3-azido-5-(hydroxymethyl)cyclohexene-1-carboxylic acid Openeye Name: (3S,4S,5R)-4-acetamido-3-azido-5-(hydroxymethyl)cyclohexene-1-carboxylic acid CAS Name: (3S,4S,5R)-4-acetamido-3-azido-5-(hydroxymethyl)-1-cyclohexenecarboxylic acid IUPAC Name: (3S,4S,5R)-4-acetamido-3-azido-5-(hydroxymethyl)cyclohexene-1-carboxylic acid Traditional Name: (3S,4S,5R)-4-acetamido-3-azido-5-methylol-cyclohexene-1-carboxylic acid Formula: C10H14N4O4 MolecularWeight: 254.24256

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CC(=CC1N=[N+]=[N-])C(=O)O)CO

Isomeric SMILES

CC(=O)N[C@H]1[C@@H](CC(=C[C@@H]1N=[N+]=[N-])C(=O)O)CO

InChI

InChI=1S/C10H14N4O4/c1-5(16)12-9-7(4-15)2-6(10(17)18)3-8(9)13-14-11/h3,7-9,15H,2,4H2,1H3,(H,12,16)(H,17,18)/t7-,8-,9-/m0/s1