diphenyl 3-(1-formamido-3-oxidanylidene-propyl)-6-(phenylsulfonyl)benzene-1,2-disulfonate

Systemtic Name: diphenyl 3-(1-formamido-3-oxidanylidene-propyl)-6-(phenylsulfonyl)benzene-1,2-disulfonate Openeye Name: diphenyl 3-(benzenesulfonyl)-6-(1-formamido-3-oxo-propyl)benzene-1,2-disulfonate CAS Name: 3-(benzenesulfonyl)-6-(1-formamido-3-oxopropyl)benzene-1,2-disulfonic acid diphenyl ester IUPAC Name: diphenyl 3-(benzenesulfonyl)-6-(1-formamido-3-oxopropyl)benzene-1,2-disulfonate Traditional Name: 3-besyl-6-(1-formamido-3-keto-propyl)benzene-1,2-disulfonic acid diphenyl ester Formula: C28H23NO10S3 MolecularWeight: 629.67792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C(CC=O)NC=O

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2S(=O)(=O)OC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C(CC=O)NC=O

InChI

InChI=1S/C28H23NO10S3/c30-19-18-25(29-20-31)24-16-17-26(40(32,33)23-14-8-3-9-15-23)28(42(36,37)39-22-12-6-2-7-13-22)27(24)41(34,35)38-21-10-4-1-5-11-21/h1-17,19-20,25H,18H2,(H,29,31)