[3-(2-azaniumylethyl)-1H-indol-5-yl] sulfate

Systemtic Name: [3-(2-azaniumylethyl)-1H-indol-5-yl] sulfate Openeye Name: [3-(2-azaniumylethyl)-1H-indol-5-yl] sulfate CAS Name: [3-(2-ammonioethyl)-1H-indol-5-yl] sulfate IUPAC Name: [3-(2-azaniumylethyl)-1H-indol-5-yl] sulfate Traditional Name: [3-(2-ammonioethyl)-1H-indol-5-yl] sulfate Formula: C10H12N2O4S MolecularWeight: 256.27828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OS(=O)(=O)[O-])C(=CN2)CC[NH3+]

Isomeric SMILES

C1=CC2=C(C=C1OS(=O)(=O)[O-])C(=CN2)CC[NH3+]

InChI

InChI=1S/C10H12N2O4S/c11-4-3-7-6-12-10-2-1-8(5-9(7)10)16-17(13,14)15/h1-2,5-6,12H,3-4,11H2,(H,13,14,15)