5-azanyl-2-[(E)-2-(4-sulfophenyl)ethenyl]benzenesulfonic acid

Systemtic Name: 5-azanyl-2-[(E)-2-(4-sulfophenyl)ethenyl]benzenesulfonic acid Openeye Name: 5-amino-2-[(E)-2-(4-sulfophenyl)vinyl]benzenesulfonic acid CAS Name: 5-amino-2-[(E)-2-(4-sulfophenyl)ethenyl]benzenesulfonic acid IUPAC Name: 5-amino-2-[(E)-2-(4-sulfophenyl)ethenyl]benzenesulfonic acid Traditional Name: 5-amino-2-[(E)-2-(4-sulfophenyl)vinyl]besylic acid Formula: C14H13NO6S2 MolecularWeight: 355.38612

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=CC2=C(C=C(C=C2)N)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC(=CC=C1/C=C/C2=C(C=C(C=C2)N)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C14H13NO6S2/c15-12-6-5-11(14(9-12)23(19,20)21)4-1-10-2-7-13(8-3-10)22(16,17)18/h1-9H,15H2,(H,16,17,18)(H,19,20,21)/b4-1+