2-[4-[bis(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-3-(2-oxidanidyl-2-oxidanylidene-ethoxy)phenyl]-1H-indole-6-carboxylate

Systemtic Name: 2-[4-[bis(2-oxidanidyl-2-oxidanylidene-ethyl)amino]-3-(2-oxidanidyl-2-oxidanylidene-ethoxy)phenyl]-1H-indole-6-carboxylate Openeye Name: 2-[4-[bis(2-oxido-2-oxo-ethyl)amino]-3-(2-oxido-2-oxo-ethoxy)phenyl]-1H-indole-6-carboxylate CAS Name: 2-[4-[bis(2-oxido-2-oxoethyl)amino]-3-(2-oxido-2-oxoethoxy)phenyl]-1H-indole-6-carboxylate IUPAC Name: 2-[4-[bis(2-oxido-2-oxoethyl)amino]-3-(2-oxido-2-oxoethoxy)phenyl]-1H-indole-6-carboxylate Traditional Name: 2-[4-[bis(2-keto-2-oxido-ethyl)amino]-3-(2-keto-2-oxido-ethoxy)phenyl]-1H-indole-6-carboxylate Formula: C21H14N2O9-4 MolecularWeight: 438.34386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C2=CC3=C(N2)C=C(C=C3)C(=O)[O-])OCC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-]

Isomeric SMILES

C1=CC(=C(C=C1C2=CC3=C(N2)C=C(C=C3)C(=O)[O-])OCC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-]

InChI

InChI=1S/C21H18N2O9/c24-18(25)8-23(9-19(26)27)16-4-3-12(7-17(16)32-10-20(28)29)14-5-11-1-2-13(21(30)31)6-15(11)22-14/h1-7,22H,8-10H2,(H,24,25)(H,26,27)(H,28,29)(H,30,31)/p-4