butyl 5-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: butyl 5-[[9,10-bis(oxidanylidene)anthracen-2-yl]sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: butyl 5-[(9,10-dioxo-2-anthryl)sulfonylamino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[(9,10-dioxo-2-anthracenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylic acid butyl ester IUPAC Name: butyl 5-[(9,10-dioxoanthracen-2-yl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[(9,10-diketo-2-anthryl)sulfonylamino]-2-methyl-benzofuran-3-carboxylic acid butyl ester Formula: C28H23NO7S MolecularWeight: 517.54972

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O)C

Isomeric SMILES

CCCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=CC4=C(C=C3)C(=O)C5=CC=CC=C5C4=O)C

InChI

InChI=1S/C28H23NO7S/c1-3-4-13-35-28(32)25-16(2)36-24-12-9-17(14-23(24)25)29-37(33,34)18-10-11-21-22(15-18)27(31)20-8-6-5-7-19(20)26(21)30/h5-12,14-15,29H,3-4,13H2,1-2H3