1-[3-(methylamino)-3-oxidanylidene-prop-1-en-2-yl]cyclohexane-1,2-dicarboxylic acid

Systemtic Name: 1-[3-(methylamino)-3-oxidanylidene-prop-1-en-2-yl]cyclohexane-1,2-dicarboxylic acid Openeye Name: 1-[1-(methylcarbamoyl)vinyl]cyclohexane-1,2-dicarboxylic acid CAS Name: 1-[3-(methylamino)-3-oxoprop-1-en-2-yl]cyclohexane-1,2-dicarboxylic acid IUPAC Name: 1-[3-(methylamino)-3-oxoprop-1-en-2-yl]cyclohexane-1,2-dicarboxylic acid Traditional Name: 1-[1-(methylcarbamoyl)vinyl]cyclohexane-1,2-dicarboxylic acid Formula: C12H17NO5 MolecularWeight: 255.26708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C(=C)C1(CCCCC1C(=O)O)C(=O)O

Isomeric SMILES

CNC(=O)C(=C)C1(CCCCC1C(=O)O)C(=O)O

InChI

InChI=1S/C12H17NO5/c1-7(9(14)13-2)12(11(17)18)6-4-3-5-8(12)10(15)16/h8H,1,3-6H2,2H3,(H,13,14)(H,15,16)(H,17,18)