phenyl N-[[(4-nitrophenyl)amino]methyl]sulfamate

Systemtic Name: phenyl N-[[(4-nitrophenyl)amino]methyl]sulfamate Openeye Name: phenyl N-[(4-nitroanilino)methyl]sulfamate CAS Name: N-[(4-nitroanilino)methyl]sulfamic acid phenyl ester IUPAC Name: phenyl N-[(4-nitroanilino)methyl]sulfamate Traditional Name: N-[(4-nitroanilino)methyl]sulfamic acid phenyl ester Formula: C13H13N3O5S MolecularWeight: 323.32442

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OS(=O)(=O)NCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OS(=O)(=O)NCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H13N3O5S/c17-16(18)12-8-6-11(7-9-12)14-10-15-22(19,20)21-13-4-2-1-3-5-13/h1-9,14-15H,10H2