disodium 5-azanyl-2-[(E)-2-(3-azanyl-5-sulfonato-phenyl)ethenyl]benzenesulfonate

Systemtic Name: disodium 5-azanyl-2-[(E)-2-(3-azanyl-5-sulfonato-phenyl)ethenyl]benzenesulfonate Openeye Name: disodium 5-amino-2-[(E)-2-(3-amino-5-sulfonato-phenyl)vinyl]benzenesulfonate CAS Name: disodium 5-amino-2-[(E)-2-(3-amino-5-sulfonatophenyl)ethenyl]benzenesulfonate IUPAC Name: disodium 5-amino-2-[(E)-2-(3-amino-5-sulfonatophenyl)ethenyl]benzenesulfonate Traditional Name: disodium 5-amino-2-[(E)-2-(3-amino-5-sulfonato-phenyl)vinyl]besylate Formula: C14H12N2Na2O6S2 MolecularWeight: 414.36442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)S(=O)(=O)[O-])C=CC2=CC(=CC(=C2)S(=O)(=O)[O-])N.[Na+].[Na+]

Isomeric SMILES

C1=CC(=C(C=C1N)S(=O)(=O)[O-])/C=C/C2=CC(=CC(=C2)S(=O)(=O)[O-])N.[Na+].[Na+]

InChI

InChI=1S/C14H14N2O6S2.2Na/c15-11-4-3-10(14(8-11)24(20,21)22)2-1-9-5-12(16)7-13(6-9)23(17,18)19;;/h1-8H,15-16H2,(H,17,18,19)(H,20,21,22);;/q;2*+1/p-2/b2-1+;;