phenyl oxidanylidene-[[3-oxidanylidene-1-phenyl-2,3-bis(phenylsulfonyl)propyl]amino]methanesulfonate

Systemtic Name: phenyl oxidanylidene-[[3-oxidanylidene-1-phenyl-2,3-bis(phenylsulfonyl)propyl]amino]methanesulfonate Openeye Name: phenyl [[2,3-bis(benzenesulfonyl)-3-oxo-1-phenyl-propyl]amino]-oxo-methanesulfonate CAS Name: [[2,3-bis(benzenesulfonyl)-3-oxo-1-phenylpropyl]amino]-oxomethanesulfonic acid phenyl ester IUPAC Name: phenyl [[2,3-bis(benzenesulfonyl)-3-oxo-1-phenylpropyl]amino]-oxomethanesulfonate Traditional Name: [(2,3-dibesyl-3-keto-1-phenyl-propyl)amino]-keto-methanesulfonic acid phenyl ester Formula: C28H23NO9S3 MolecularWeight: 613.67852

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C28H23NO9S3/c30-27(40(34,35)24-19-11-4-12-20-24)26(39(32,33)23-17-9-3-10-18-23)25(21-13-5-1-6-14-21)29-28(31)41(36,37)38-22-15-7-2-8-16-22/h1-20,25-26H,(H,29,31)