2-[2-[bis[(2-hydroxyphenyl)methyl]-(2-oxidanidyl-2-oxidanylidene-ethyl)azaniumyl]ethylamino]ethanoate

Systemtic Name: 2-[2-[bis[(2-hydroxyphenyl)methyl]-(2-oxidanidyl-2-oxidanylidene-ethyl)azaniumyl]ethylamino]ethanoate Openeye Name: 2-[2-[bis[(2-hydroxyphenyl)methyl]-(2-oxido-2-oxo-ethyl)ammonio]ethylamino]acetate CAS Name: 2-[2-[bis[(2-hydroxyphenyl)methyl]-(2-oxido-2-oxoethyl)ammonio]ethylamino]acetate IUPAC Name: 2-[2-[bis[(2-hydroxyphenyl)methyl]-(2-oxido-2-oxoethyl)azaniumyl]ethylamino]acetate Traditional Name: 2-[2-[(2-keto-2-oxido-ethyl)-disalicyl-ammonio]ethylamino]acetate Formula: C20H23N2O6- MolecularWeight: 387.40642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C[N+](CCNCC(=O)[O-])(CC2=CC=CC=C2O)CC(=O)[O-])O

Isomeric SMILES

C1=CC=C(C(=C1)C[N+](CCNCC(=O)[O-])(CC2=CC=CC=C2O)CC(=O)[O-])O

InChI

InChI=1S/C20H24N2O6/c23-17-7-3-1-5-15(17)12-22(14-20(27)28,10-9-21-11-19(25)26)13-16-6-2-4-8-18(16)24/h1-8,21H,9-14H2,(H3-,23,24,25,26,27,28)/p-1