5-(prop-2-enylcarbamoyl)benzene-1,2,4-tricarboxylic acid

Systemtic Name: 5-(prop-2-enylcarbamoyl)benzene-1,2,4-tricarboxylic acid Openeye Name: 5-(allylcarbamoyl)benzene-1,2,4-tricarboxylic acid CAS Name: 5-[oxo-(prop-2-enylamino)methyl]benzene-1,2,4-tricarboxylic acid IUPAC Name: 5-(prop-2-enylcarbamoyl)benzene-1,2,4-tricarboxylic acid Traditional Name: 5-(allylcarbamoyl)trimellitic acid Formula: C13H11NO7 MolecularWeight: 293.22894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O

Isomeric SMILES

C=CCNC(=O)C1=CC(=C(C=C1C(=O)O)C(=O)O)C(=O)O

InChI

InChI=1S/C13H11NO7/c1-2-3-14-10(15)6-4-8(12(18)19)9(13(20)21)5-7(6)11(16)17/h2,4-5H,1,3H2,(H,14,15)(H,16,17)(H,18,19)(H,20,21)