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

Systemtic Name: 5-benzamido-2-[(E)-2-(2-sulfophenyl)ethenyl]benzenesulfonic acid Openeye Name: 5-benzamido-2-[(E)-2-(2-sulfophenyl)vinyl]benzenesulfonic acid CAS Name: 5-benzamido-2-[(E)-2-(2-sulfophenyl)ethenyl]benzenesulfonic acid IUPAC Name: 5-benzamido-2-[(E)-2-(2-sulfophenyl)ethenyl]benzenesulfonic acid Traditional Name: 5-benzamido-2-[(E)-2-(2-sulfophenyl)vinyl]besylic acid Formula: C21H17NO7S2 MolecularWeight: 459.49218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)C=CC3=CC=CC=C3S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2)/C=C/C3=CC=CC=C3S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C21H17NO7S2/c23-21(17-7-2-1-3-8-17)22-18-13-12-16(20(14-18)31(27,28)29)11-10-15-6-4-5-9-19(15)30(24,25)26/h1-14H,(H,22,23)(H,24,25,26)(H,27,28,29)/b11-10+