(E)-4-oxidanyl-2-oxidanylidene-4-[1-(phenylsulfonyl)pyrrol-3-yl]but-3-enoic acid

Systemtic Name: (E)-4-oxidanyl-2-oxidanylidene-4-[1-(phenylsulfonyl)pyrrol-3-yl]but-3-enoic acid Openeye Name: (E)-4-[1-(benzenesulfonyl)pyrrol-3-yl]-4-hydroxy-2-oxo-but-3-enoic acid CAS Name: (E)-4-[1-(benzenesulfonyl)-3-pyrrolyl]-4-hydroxy-2-oxo-3-butenoic acid IUPAC Name: (E)-4-[1-(benzenesulfonyl)pyrrol-3-yl]-4-hydroxy-2-oxobut-3-enoic acid Traditional Name: (E)-4-(1-besylpyrrol-3-yl)-4-hydroxy-2-keto-but-3-enoic acid Formula: C14H11NO6S MolecularWeight: 321.30524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=CC(=O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)/C(=C\C(=O)C(=O)O)/O

InChI

InChI=1S/C14H11NO6S/c16-12(8-13(17)14(18)19)10-6-7-15(9-10)22(20,21)11-4-2-1-3-5-11/h1-9,16H,(H,18,19)/b12-8+