(3R,4R,5S)-4-acetamido-5-ethenyl-3-propan-2-yloxy-cyclohexene-1-carboxylic acid

Systemtic Name: (3R,4R,5S)-4-acetamido-5-ethenyl-3-propan-2-yloxy-cyclohexene-1-carboxylic acid Openeye Name: (3R,4R,5S)-4-acetamido-3-isopropoxy-5-vinyl-cyclohexene-1-carboxylic acid CAS Name: (3R,4R,5S)-4-acetamido-5-ethenyl-3-propan-2-yloxy-1-cyclohexenecarboxylic acid IUPAC Name: (3R,4R,5S)-4-acetamido-5-ethenyl-3-propan-2-yloxycyclohexene-1-carboxylic acid Traditional Name: (3R,4R,5S)-4-acetamido-3-isopropoxy-5-vinyl-cyclohexene-1-carboxylic acid Formula: C14H21NO4 MolecularWeight: 267.32084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1C=C(CC(C1NC(=O)C)C=C)C(=O)O

Isomeric SMILES

CC(C)O[C@@H]1C=C(C[C@H]([C@H]1NC(=O)C)C=C)C(=O)O

InChI

InChI=1S/C14H21NO4/c1-5-10-6-11(14(17)18)7-12(19-8(2)3)13(10)15-9(4)16/h5,7-8,10,12-13H,1,6H2,2-4H3,(H,15,16)(H,17,18)/t10-,12-,13-/m1/s1