4-[[2,3-bis(oxidanylidene)indol-1-yl]methyl]benzenesulfonic acid

Systemtic Name: 4-[[2,3-bis(oxidanylidene)indol-1-yl]methyl]benzenesulfonic acid Openeye Name: 4-[(2,3-dioxoindolin-1-yl)methyl]benzenesulfonic acid CAS Name: 4-[(2,3-dioxo-1-indolyl)methyl]benzenesulfonic acid IUPAC Name: 4-[(2,3-dioxoindol-1-yl)methyl]benzenesulfonic acid Traditional Name: 4-[(2,3-diketoindolin-1-yl)methyl]besylic acid Formula: C15H11NO5S MolecularWeight: 317.31654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=O)N2CC3=CC=C(C=C3)S(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=O)N2CC3=CC=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C15H11NO5S/c17-14-12-3-1-2-4-13(12)16(15(14)18)9-10-5-7-11(8-6-10)22(19,20)21/h1-8H,9H2,(H,19,20,21)