5-methoxy-3-(3-oxidanidyl-3-oxidanylidene-propyl)-1H-indole-2-carboxylate

Systemtic Name: 5-methoxy-3-(3-oxidanidyl-3-oxidanylidene-propyl)-1H-indole-2-carboxylate Openeye Name: 5-methoxy-3-(3-oxido-3-oxo-propyl)-1H-indole-2-carboxylate CAS Name: 5-methoxy-3-(3-oxido-3-oxopropyl)-1H-indole-2-carboxylate IUPAC Name: 5-methoxy-3-(3-oxido-3-oxopropyl)-1H-indole-2-carboxylate Traditional Name: 3-(3-keto-3-oxido-propyl)-5-methoxy-1H-indole-2-carboxylate Formula: C13H11NO5-2 MolecularWeight: 261.23014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)NC(=C2CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

COC1=CC2=C(C=C1)NC(=C2CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H13NO5/c1-19-7-2-4-10-9(6-7)8(3-5-11(15)16)12(14-10)13(17)18/h2,4,6,14H,3,5H2,1H3,(H,15,16)(H,17,18)/p-2