(3R,4R,5S)-4-acetamido-5-azanyl-3-prop-2-enoxy-cyclohexene-1-carboxylic acid

Systemtic Name: (3R,4R,5S)-4-acetamido-5-azanyl-3-prop-2-enoxy-cyclohexene-1-carboxylic acid Openeye Name: (3R,4R,5S)-4-acetamido-3-allyloxy-5-amino-cyclohexene-1-carboxylic acid CAS Name: (3R,4R,5S)-4-acetamido-5-amino-3-prop-2-enoxy-1-cyclohexenecarboxylic acid IUPAC Name: (3R,4R,5S)-4-acetamido-5-amino-3-prop-2-enoxycyclohexene-1-carboxylic acid Traditional Name: (3R,4R,5S)-4-acetamido-3-allyloxy-5-amino-cyclohexene-1-carboxylic acid Formula: C12H18N2O4 MolecularWeight: 254.28232

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1C(CC(=CC1OCC=C)C(=O)O)N

Isomeric SMILES

CC(=O)N[C@@H]1[C@H](CC(=C[C@H]1OCC=C)C(=O)O)N

InChI

InChI=1S/C12H18N2O4/c1-3-4-18-10-6-8(12(16)17)5-9(13)11(10)14-7(2)15/h3,6,9-11H,1,4-5,13H2,2H3,(H,14,15)(H,16,17)/t9-,10+,11+/m0/s1