trisodium 2-(carboxymethylamino)-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: trisodium 2-(carboxymethylamino)-3-(1H-indol-3-yl)propanoic acid Openeye Name: trisodium 2-(carboxymethylamino)-3-(1H-indol-3-yl)propanoic acid CAS Name: trisodium 2-(carboxymethylamino)-3-(1H-indol-3-yl)propanoic acid IUPAC Name: trisodium 2-(carboxymethylamino)-3-(1H-indol-3-yl)propanoic acid Traditional Name: trisodium 2-(carboxymethylamino)-3-(1H-indol-3-yl)propionic acid Formula: C13H14N2Na3O4+3 MolecularWeight: 331.23057

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NCC(=O)O.[Na+].[Na+].[Na+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CC(C(=O)O)NCC(=O)O.[Na+].[Na+].[Na+]

InChI

InChI=1S/C13H14N2O4.3Na/c16-12(17)7-15-11(13(18)19)5-8-6-14-10-4-2-1-3-9(8)10;;;/h1-4,6,11,14-15H,5,7H2,(H,16,17)(H,18,19);;;/q;3*+1