(Z)-4-oxidanylidene-4-phenylazanyl-3-sulfo-but-2-enoic acid

Systemtic Name: (Z)-4-oxidanylidene-4-phenylazanyl-3-sulfo-but-2-enoic acid Openeye Name: (Z)-4-anilino-4-oxo-3-sulfo-but-2-enoic acid CAS Name: (Z)-4-anilino-4-oxo-3-sulfo-2-butenoic acid IUPAC Name: (Z)-4-anilino-4-oxo-3-sulfobut-2-enoic acid Traditional Name: (Z)-4-anilino-4-keto-3-sulfo-but-2-enoic acid Formula: C10H9NO6S MolecularWeight: 271.24656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(=CC(=O)O)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)/C(=C/C(=O)O)/S(=O)(=O)O

InChI

InChI=1S/C10H9NO6S/c12-9(13)6-8(18(15,16)17)10(14)11-7-4-2-1-3-5-7/h1-6H,(H,11,14)(H,12,13)(H,15,16,17)/b8-6-