[2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate

Systemtic Name: [2-(4-cyclohexylphenyl)-2-oxidanylidene-ethyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate Openeye Name: [2-(4-cyclohexylphenyl)-2-oxo-ethyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoic acid [2-(4-cyclohexylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-cyclohexylphenyl)-2-oxoethyl] 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoate Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonylamino)benzoic acid [2-(4-cyclohexylphenyl)-2-keto-ethyl] ester Formula: C29H29NO7S MolecularWeight: 535.60806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)C(=O)COC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC5=C(C=C4)OCCO5

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)C(=O)COC(=O)C3=CC=CC=C3NS(=O)(=O)C4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C29H29NO7S/c31-26(22-12-10-21(11-13-22)20-6-2-1-3-7-20)19-37-29(32)24-8-4-5-9-25(24)30-38(33,34)23-14-15-27-28(18-23)36-17-16-35-27/h4-5,8-15,18,20,30H,1-3,6-7,16-17,19H2