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

Systemtic Name: phenyl 3-(1-formamido-3-oxidanylidene-propyl)-2,6-bis(oxidanyl)benzenesulfonate Openeye Name: phenyl 3-(1-formamido-3-oxo-propyl)-2,6-dihydroxy-benzenesulfonate CAS Name: 3-(1-formamido-3-oxopropyl)-2,6-dihydroxybenzenesulfonic acid phenyl ester IUPAC Name: phenyl 3-(1-formamido-3-oxopropyl)-2,6-dihydroxybenzenesulfonate Traditional Name: 3-(1-formamido-3-keto-propyl)-2,6-dihydroxy-benzenesulfonic acid phenyl ester Formula: C16H15NO7S MolecularWeight: 365.3578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2O)C(CC=O)NC=O)O

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2O)C(CC=O)NC=O)O

InChI

InChI=1S/C16H15NO7S/c18-9-8-13(17-10-19)12-6-7-14(20)16(15(12)21)25(22,23)24-11-4-2-1-3-5-11/h1-7,9-10,13,20-21H,8H2,(H,17,19)