4,4-bis(azanyl)-3-(2-hydroxyphenyl)-3-oxidanyl-cyclohexa-1,5-diene-1-carboxylate

Systemtic Name: 4,4-bis(azanyl)-3-(2-hydroxyphenyl)-3-oxidanyl-cyclohexa-1,5-diene-1-carboxylate Openeye Name: 4,4-diamino-3-hydroxy-3-(2-hydroxyphenyl)cyclohexa-1,5-diene-1-carboxylate CAS Name: 4,4-diamino-3-hydroxy-3-(2-hydroxyphenyl)-1-cyclohexa-1,5-dienecarboxylate IUPAC Name: 4,4-diamino-3-hydroxy-3-(2-hydroxyphenyl)cyclohexa-1,5-diene-1-carboxylate Traditional Name: 4,4-diamino-3-hydroxy-3-(2-hydroxyphenyl)cyclohexa-1,5-diene-1-carboxylate Formula: C13H13N2O4- MolecularWeight: 261.25332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2(C=C(C=CC2(N)N)C(=O)[O-])O)O

Isomeric SMILES

C1=CC=C(C(=C1)C2(C=C(C=CC2(N)N)C(=O)[O-])O)O

InChI

InChI=1S/C13H14N2O4/c14-13(15)6-5-8(11(17)18)7-12(13,19)9-3-1-2-4-10(9)16/h1-7,16,19H,14-15H2,(H,17,18)/p-1