2-[1-(carboxymethyl)-5-chloranyl-indol-3-yl]ethanoic acid

Systemtic Name: 2-[1-(carboxymethyl)-5-chloranyl-indol-3-yl]ethanoic acid Openeye Name: 2-[1-(carboxymethyl)-5-chloro-indol-3-yl]acetic acid CAS Name: 2-[1-(carboxymethyl)-5-chloro-3-indolyl]acetic acid IUPAC Name: 2-[1-(carboxymethyl)-5-chloroindol-3-yl]acetic acid Traditional Name: 2-[1-(carboxymethyl)-5-chloro-indol-3-yl]acetic acid Formula: C12H10ClNO4 MolecularWeight: 267.6651

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=CN2CC(=O)O)CC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=CN2CC(=O)O)CC(=O)O

InChI

InChI=1S/C12H10ClNO4/c13-8-1-2-10-9(4-8)7(3-11(15)16)5-14(10)6-12(17)18/h1-2,4-5H,3,6H2,(H,15,16)(H,17,18)