phenyl 3-(1-formamido-3-oxidanylidene-propyl)-2,6-bis(2-hydroxyphenyl)benzenesulfonate

Systemtic Name: phenyl 3-(1-formamido-3-oxidanylidene-propyl)-2,6-bis(2-hydroxyphenyl)benzenesulfonate Openeye Name: phenyl 3-(1-formamido-3-oxo-propyl)-2,6-bis(2-hydroxyphenyl)benzenesulfonate CAS Name: 3-(1-formamido-3-oxopropyl)-2,6-bis(2-hydroxyphenyl)benzenesulfonic acid phenyl ester IUPAC Name: phenyl 3-(1-formamido-3-oxopropyl)-2,6-bis(2-hydroxyphenyl)benzenesulfonate Traditional Name: 3-(1-formamido-3-keto-propyl)-2,6-bis(2-hydroxyphenyl)benzenesulfonic acid phenyl ester Formula: C28H23NO7S MolecularWeight: 517.54972

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2C3=CC=CC=C3O)C(CC=O)NC=O)C4=CC=CC=C4O

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2C3=CC=CC=C3O)C(CC=O)NC=O)C4=CC=CC=C4O

InChI

InChI=1S/C28H23NO7S/c30-17-16-24(29-18-31)22-15-14-21(20-10-4-6-12-25(20)32)28(27(22)23-11-5-7-13-26(23)33)37(34,35)36-19-8-2-1-3-9-19/h1-15,17-18,24,32-33H,16H2,(H,29,31)