diphenyl 1-oxidanylidene-3-(phenoxysulfonylcarbonylamino)-3-phenyl-propane-1,2-disulfonate

Systemtic Name: diphenyl 1-oxidanylidene-3-(phenoxysulfonylcarbonylamino)-3-phenyl-propane-1,2-disulfonate Openeye Name: diphenyl 1-oxo-3-(phenoxysulfonylcarbonylamino)-3-phenyl-propane-1,2-disulfonate CAS Name: 1-oxo-3-[[oxo(phenoxysulfonyl)methyl]amino]-3-phenylpropane-1,2-disulfonic acid diphenyl ester IUPAC Name: diphenyl 1-oxo-3-(phenoxysulfonylcarbonylamino)-3-phenylpropane-1,2-disulfonate Traditional Name: 1-keto-3-(phenoxysulfonylcarbonylamino)-3-phenyl-propane-1,2-disulfonic acid diphenyl ester Formula: C28H23NO11S3 MolecularWeight: 645.67732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(C(=O)S(=O)(=O)OC2=CC=CC=C2)S(=O)(=O)OC3=CC=CC=C3)NC(=O)S(=O)(=O)OC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(C(C(=O)S(=O)(=O)OC2=CC=CC=C2)S(=O)(=O)OC3=CC=CC=C3)NC(=O)S(=O)(=O)OC4=CC=CC=C4

InChI

InChI=1S/C28H23NO11S3/c30-27(42(34,35)39-23-17-9-3-10-18-23)26(41(32,33)38-22-15-7-2-8-16-22)25(21-13-5-1-6-14-21)29-28(31)43(36,37)40-24-19-11-4-12-20-24/h1-20,25-26H,(H,29,31)