phenyl (NE)-N-[[5-[(E)-phenoxyperoxysulfanyliminomethyl]-3H-pyrrol-2-yl]methylidene]sulfamate

Systemtic Name: phenyl (NE)-N-[[5-[(E)-phenoxyperoxysulfanyliminomethyl]-3H-pyrrol-2-yl]methylidene]sulfamate Openeye Name: phenyl (NE)-N-[[5-[(E)-phenoxyperoxysulfanyliminomethyl]-3H-pyrrol-2-yl]methylene]sulfamate CAS Name: (NE)-N-[[5-[(E)-(phenoxydioxythio)iminomethyl]-3H-pyrrol-2-yl]methylidene]sulfamic acid phenyl ester IUPAC Name: phenyl (NE)-N-[[5-[(E)-phenoxyperoxysulfanyliminomethyl]-3H-pyrrol-2-yl]methylidene]sulfamate Traditional Name: (NE)-N-[[5-[(E)-(phenoxyperoxythio)iminomethyl]-3H-pyrrol-2-yl]methylene]sulfamic acid phenyl ester Formula: C18H15N3O6S2 MolecularWeight: 433.4582

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Descriptors Computed from Structure

Canonical SMILES:

C1C=C(N=C1C=NS(=O)(=O)OC2=CC=CC=C2)C=NSOOOC3=CC=CC=C3

Isomeric SMILES

C1C=C(N=C1/C=N/S(=O)(=O)OC2=CC=CC=C2)/C=N/SOOOC3=CC=CC=C3

InChI

InChI=1S/C18H15N3O6S2/c22-29(23,25-18-9-5-2-6-10-18)20-14-16-12-11-15(21-16)13-19-28-27-26-24-17-7-3-1-4-8-17/h1-11,13-14H,12H2/b19-13+,20-14+