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

Systemtic Name: phenyl 6-(1-formamido-3-oxidanylidene-propyl)-3-methoxy-2-oxidanyl-benzenesulfonate Openeye Name: phenyl 6-(1-formamido-3-oxo-propyl)-2-hydroxy-3-methoxy-benzenesulfonate CAS Name: 6-(1-formamido-3-oxopropyl)-2-hydroxy-3-methoxybenzenesulfonic acid phenyl ester IUPAC Name: phenyl 6-(1-formamido-3-oxopropyl)-2-hydroxy-3-methoxybenzenesulfonate Traditional Name: 6-(1-formamido-3-keto-propyl)-2-hydroxy-3-methoxy-benzenesulfonic acid phenyl ester Formula: C17H17NO7S MolecularWeight: 379.38438

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(CC=O)NC=O)S(=O)(=O)OC2=CC=CC=C2)O

Isomeric SMILES

COC1=C(C(=C(C=C1)C(CC=O)NC=O)S(=O)(=O)OC2=CC=CC=C2)O

InChI

InChI=1S/C17H17NO7S/c1-24-15-8-7-13(14(9-10-19)18-11-20)17(16(15)21)26(22,23)25-12-5-3-2-4-6-12/h2-8,10-11,14,21H,9H2,1H3,(H,18,20)