4-(7-benzamidodibenzofuran-2-yl)sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid

Systemtic Name: 4-(7-benzamidodibenzofuran-2-yl)sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid Openeye Name: 4-(7-benzamidodibenzofuran-2-yl)sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid CAS Name: 4-[(7-benzamido-2-dibenzofuranyl)sulfonyl]-2,2-dimethyl-3-thiomorpholinecarboxylic acid IUPAC Name: 4-(7-benzamidodibenzofuran-2-yl)sulfonyl-2,2-dimethylthiomorpholine-3-carboxylic acid Traditional Name: 4-(7-benzamidodibenzofuran-2-yl)sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid Formula: C26H24N2O6S2 MolecularWeight: 524.60856

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CCS1)S(=O)(=O)C2=CC3=C(C=C2)OC4=C3C=CC(=C4)NC(=O)C5=CC=CC=C5)C(=O)O)C

Isomeric SMILES

CC1(C(N(CCS1)S(=O)(=O)C2=CC3=C(C=C2)OC4=C3C=CC(=C4)NC(=O)C5=CC=CC=C5)C(=O)O)C

InChI

InChI=1S/C26H24N2O6S2/c1-26(2)23(25(30)31)28(12-13-35-26)36(32,33)18-9-11-21-20(15-18)19-10-8-17(14-22(19)34-21)27-24(29)16-6-4-3-5-7-16/h3-11,14-15,23H,12-13H2,1-2H3,(H,27,29)(H,30,31)