1-(1H-indol-3-ylmethyl)ethane-1,1,2-tricarboxylic acid

Systemtic Name: 1-(1H-indol-3-ylmethyl)ethane-1,1,2-tricarboxylic acid Openeye Name: 1-(1H-indol-3-ylmethyl)ethane-1,1,2-tricarboxylic acid CAS Name: 1-(1H-indol-3-ylmethyl)ethane-1,1,2-tricarboxylic acid IUPAC Name: 1-(1H-indol-3-ylmethyl)ethane-1,1,2-tricarboxylic acid Traditional Name: 1-(1H-indol-3-ylmethyl)ethane-1,1,2-tricarboxylic acid Formula: C14H13NO6 MolecularWeight: 291.25612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(CC(=O)O)(C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(CC(=O)O)(C(=O)O)C(=O)O

InChI

InChI=1S/C14H13NO6/c16-11(17)6-14(12(18)19,13(20)21)5-8-7-15-10-4-2-1-3-9(8)10/h1-4,7,15H,5-6H2,(H,16,17)(H,18,19)(H,20,21)