(4R,5S)-4-acetamido-5-azanyl-3-propoxy-cyclohexene-1-carboxylic acid

Systemtic Name: (4R,5S)-4-acetamido-5-azanyl-3-propoxy-cyclohexene-1-carboxylic acid Openeye Name: (4R,5S)-4-acetamido-5-amino-3-propoxy-cyclohexene-1-carboxylic acid CAS Name: (4R,5S)-4-acetamido-5-amino-3-propoxy-1-cyclohexenecarboxylic acid IUPAC Name: (4R,5S)-4-acetamido-5-amino-3-propoxycyclohexene-1-carboxylic acid Traditional Name: (4R,5S)-4-acetamido-5-amino-3-propoxy-cyclohexene-1-carboxylic acid Formula: C12H20N2O4 MolecularWeight: 256.2982

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1C=C(CC(C1NC(=O)C)N)C(=O)O

Isomeric SMILES

CCCOC1C=C(C[C@@H]([C@H]1NC(=O)C)N)C(=O)O

InChI

InChI=1S/C12H20N2O4/c1-3-4-18-10-6-8(12(16)17)5-9(13)11(10)14-7(2)15/h6,9-11H,3-5,13H2,1-2H3,(H,14,15)(H,16,17)/t9-,10?,11+/m0/s1