4-[7-[(2-methoxyphenyl)carbonylamino]dibenzofuran-2-yl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid

Systemtic Name: 4-[7-[(2-methoxyphenyl)carbonylamino]dibenzofuran-2-yl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid Openeye Name: 4-[7-[(2-methoxybenzoyl)amino]dibenzofuran-2-yl]sulfonyl-2,2-dimethyl-thiomorpholine-3-carboxylic acid CAS Name: 4-[[7-[[(2-methoxyphenyl)-oxomethyl]amino]-2-dibenzofuranyl]sulfonyl]-2,2-dimethyl-3-thiomorpholinecarboxylic acid IUPAC Name: 4-[7-[(2-methoxybenzoyl)amino]dibenzofuran-2-yl]sulfonyl-2,2-dimethylthiomorpholine-3-carboxylic acid Traditional Name: 2,2-dimethyl-4-[7-(o-anisoylamino)dibenzofuran-2-yl]sulfonyl-thiomorpholine-3-carboxylic acid Formula: C27H26N2O7S2 MolecularWeight: 554.63454

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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=C5OC)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=C5OC)C(=O)O)C

InChI

InChI=1S/C27H26N2O7S2/c1-27(2)24(26(31)32)29(12-13-37-27)38(33,34)17-9-11-22-20(15-17)18-10-8-16(14-23(18)36-22)28-25(30)19-6-4-5-7-21(19)35-3/h4-11,14-15,24H,12-13H2,1-3H3,(H,28,30)(H,31,32)