2-(1H-indol-3-yl)-2,4-diphosphono-pentanedioic acid

Systemtic Name: 2-(1H-indol-3-yl)-2,4-diphosphono-pentanedioic acid Openeye Name: 2-(1H-indol-3-yl)-2,4-diphosphono-pentanedioic acid CAS Name: 2-(1H-indol-3-yl)-2,4-diphosphonopentanedioic acid IUPAC Name: 2-(1H-indol-3-yl)-2,4-diphosphonopentanedioic acid Traditional Name: 2-(1H-indol-3-yl)-2,4-diphosphono-glutaric acid Formula: C13H15NO10P2 MolecularWeight: 407.206422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO10P2/c15-11(16)10(25(19,20)21)5-13(12(17)18,26(22,23)24)8-6-14-9-4-2-1-3-7(8)9/h1-4,6,10,14H,5H2,(H,15,16)(H,17,18)(H2,19,20,21)(H2,22,23,24)