2-[[4-[[[4-(2-carboxylato-3-oxidanidyl-3-oxidanylidene-prop-1-enyl)phenyl]amino]methylamino]phenyl]methylidene]propanedioate

Systemtic Name: 2-[[4-[[[4-(2-carboxylato-3-oxidanidyl-3-oxidanylidene-prop-1-enyl)phenyl]amino]methylamino]phenyl]methylidene]propanedioate Openeye Name: 2-[[4-[[4-(2-carboxylato-3-oxido-3-oxo-prop-1-enyl)anilino]methylamino]phenyl]methylene]propanedioate CAS Name: 2-[[4-[[4-(2-carboxylato-3-oxido-3-oxoprop-1-enyl)anilino]methylamino]phenyl]methylidene]propanedioate IUPAC Name: 2-[[4-[[4-(2-carboxylato-3-oxido-3-oxoprop-1-enyl)anilino]methylamino]phenyl]methylidene]propanedioate Traditional Name: 2-[4-[[4-(2-carboxylato-3-keto-3-oxido-prop-1-enyl)anilino]methylamino]benzylidene]malonate Formula: C21H14N2O8-4 MolecularWeight: 422.34446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C(C(=O)[O-])C(=O)[O-])NCNC2=CC=C(C=C2)C=C(C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C=C(C(=O)[O-])C(=O)[O-])NCNC2=CC=C(C=C2)C=C(C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C21H18N2O8/c24-18(25)16(19(26)27)9-12-1-5-14(6-2-12)22-11-23-15-7-3-13(4-8-15)10-17(20(28)29)21(30)31/h1-10,22-23H,11H2,(H,24,25)(H,26,27)(H,28,29)(H,30,31)/p-4