[4-[[(4-cyanophenyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl] sulfamate

Systemtic Name: [4-[[(4-cyanophenyl)-(4-cyanophenyl)carbonyl-amino]methyl]phenyl] sulfamate Openeye Name: [4-[(4-cyano-N-(4-cyanobenzoyl)anilino)methyl]phenyl] sulfamate CAS Name: sulfamic acid [4-[(4-cyano-N-[(4-cyanophenyl)-oxomethyl]anilino)methyl]phenyl] ester IUPAC Name: [4-[(4-cyano-N-(4-cyanobenzoyl)anilino)methyl]phenyl] sulfamate Traditional Name: sulfamic acid [4-[(4-cyano-N-(4-cyanobenzoyl)anilino)methyl]phenyl] ester Formula: C22H16N4O4S MolecularWeight: 432.45184

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN(C2=CC=C(C=C2)C#N)C(=O)C3=CC=C(C=C3)C#N)OS(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CN(C2=CC=C(C=C2)C#N)C(=O)C3=CC=C(C=C3)C#N)OS(=O)(=O)N

InChI

InChI=1S/C22H16N4O4S/c23-13-16-1-7-19(8-2-16)22(27)26(20-9-3-17(14-24)4-10-20)15-18-5-11-21(12-6-18)30-31(25,28)29/h1-12H,15H2,(H2,25,28,29)