4-(dimethylcarbamoylamino)indole-1,3-dicarboxylic acid

Systemtic Name: 4-(dimethylcarbamoylamino)indole-1,3-dicarboxylic acid Openeye Name: 4-(dimethylcarbamoylamino)indole-1,3-dicarboxylic acid CAS Name: 4-[[dimethylamino(oxo)methyl]amino]indole-1,3-dicarboxylic acid IUPAC Name: 4-(dimethylcarbamoylamino)indole-1,3-dicarboxylic acid Traditional Name: 4-(dimethylcarbamoylamino)indole-1,3-dicarboxylic acid Formula: C13H13N3O5 MolecularWeight: 291.25942

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)NC1=CC=CC2=C1C(=CN2C(=O)O)C(=O)O

Isomeric SMILES

CN(C)C(=O)NC1=CC=CC2=C1C(=CN2C(=O)O)C(=O)O

InChI

InChI=1S/C13H13N3O5/c1-15(2)12(19)14-8-4-3-5-9-10(8)7(11(17)18)6-16(9)13(20)21/h3-6H,1-2H3,(H,14,19)(H,17,18)(H,20,21)