2-azanidylethylazanide; (3E)-5-methyl-6-oxidanylidene-3-[(4-sulfophenyl)hydrazinylidene]cyclohexa-1,4-diene-1-carboxylate; platinum(4+)

Systemtic Name: 2-azanidylethylazanide; (3E)-5-methyl-6-oxidanylidene-3-[(4-sulfophenyl)hydrazinylidene]cyclohexa-1,4-diene-1-carboxylate; platinum(4+) Openeye Name: 2-azanidylethylazanide; (3E)-5-methyl-6-oxo-3-[(4-sulfophenyl)hydrazono]cyclohexa-1,4-diene-1-carboxylate; platinum(4+) CAS Name: 2-azanidylethylazanide; (3E)-5-methyl-6-oxo-3-[(4-sulfophenyl)hydrazinylidene]-1-cyclohexa-1,4-dienecarboxylate; platinum(4+) IUPAC Name: 2-azanidylethylazanide; (3E)-5-methyl-6-oxo-3-[(4-sulfophenyl)hydrazinylidene]cyclohexa-1,4-diene-1-carboxylate; platinum(4+) Traditional Name: 2-amidylethylazanide; (3E)-6-keto-5-methyl-3-[(4-sulfophenyl)hydrazono]cyclohexa-1,4-diene-1-carboxylate; platinum(4+) Formula: C30H28N6O12PtS2 MolecularWeight: 923.78432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NNC2=CC=C(C=C2)S(=O)(=O)O)C=C(C1=O)C(=O)[O-].CC1=CC(=NNC2=CC=C(C=C2)S(=O)(=O)O)C=C(C1=O)C(=O)[O-].C(C[NH-])[NH-].[Pt+4]

Isomeric SMILES

CC1=C/C(=N\NC2=CC=C(C=C2)S(=O)(=O)O)/C=C(C1=O)C(=O)[O-].CC1=C/C(=N\NC2=CC=C(C=C2)S(=O)(=O)O)/C=C(C1=O)C(=O)[O-].C([NH-])C[NH-].[Pt+4]

InChI

InChI=1S/2C14H12N2O6S.C2H6N2.Pt/c2*1-8-6-10(7-12(13(8)17)14(18)19)16-15-9-2-4-11(5-3-9)23(20,21)22;3-1-2-4;/h2*2-7,15H,1H3,(H,18,19)(H,20,21,22);3-4H,1-2H2;/q;;-2;+4/p-2/b2*16-10+;;