2-(1H-indol-3-ylmethylamino)ethylsulfanylphosphonic acid

Systemtic Name: 2-(1H-indol-3-ylmethylamino)ethylsulfanylphosphonic acid Openeye Name: 2-(1H-indol-3-ylmethylamino)ethylsulfanylphosphonic acid CAS Name: [2-(1H-indol-3-ylmethylamino)ethylthio]phosphonic acid IUPAC Name: 2-(1H-indol-3-ylmethylamino)ethylsulfanylphosphonic acid Traditional Name: [2-(1H-indol-3-ylmethylamino)ethylthio]phosphonic acid Formula: C11H15N2O3PS MolecularWeight: 286.287161

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15N2O3PS/c14-17(15,16)18-6-5-12-7-9-8-13-11-4-2-1-3-10(9)11/h1-4,8,12-13H,5-7H2,(H2,14,15,16)