[3,4-dimethyl-2,5-bis(oxidanylidene)pyrrol-1-yl] naphthalene-1-sulfonate

Systemtic Name: [3,4-dimethyl-2,5-bis(oxidanylidene)pyrrol-1-yl] naphthalene-1-sulfonate Openeye Name: (3,4-dimethyl-2,5-dioxo-pyrrol-1-yl) naphthalene-1-sulfonate CAS Name: 1-naphthalenesulfonic acid (3,4-dimethyl-2,5-dioxo-1-pyrrolyl) ester IUPAC Name: (3,4-dimethyl-2,5-dioxopyrrol-1-yl) naphthalene-1-sulfonate Traditional Name: naphthalene-1-sulfonic acid (2,5-diketo-3,4-dimethyl-3-pyrrolin-1-yl) ester Formula: C16H13NO5S MolecularWeight: 331.34312

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C1=O)OS(=O)(=O)C2=CC=CC3=CC=CC=C32)C

Isomeric SMILES

CC1=C(C(=O)N(C1=O)OS(=O)(=O)C2=CC=CC3=CC=CC=C32)C

InChI

InChI=1S/C16H13NO5S/c1-10-11(2)16(19)17(15(10)18)22-23(20,21)14-9-5-7-12-6-3-4-8-13(12)14/h3-9H,1-2H3