N-cyclohexylcyclohexanamine; 4-nitro-N-[2-[oxidanyl(phenyl)phosphinothioyl]oxyethyl]benzenesulfonamide

Systemtic Name: N-cyclohexylcyclohexanamine; 4-nitro-N-[2-[oxidanyl(phenyl)phosphinothioyl]oxyethyl]benzenesulfonamide Openeye Name: N-cyclohexylcyclohexanamine; N-[2-[hydroxy(phenyl)phosphinothioyl]oxyethyl]-4-nitro-benzenesulfonamide CAS Name: N-cyclohexylcyclohexanamine; N-[2-[hydroxy(phenyl)phosphinothioyl]oxyethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-cyclohexylcyclohexanamine; N-[2-[hydroxy(phenyl)phosphinothioyl]oxyethyl]-4-nitrobenzenesulfonamide Traditional Name: dicyclohexylamine; N-[2-[hydroxy(phenyl)thiophosphoryl]oxyethyl]-4-nitro-benzenesulfonamide Formula: C26H38N3O6PS2 MolecularWeight: 583.700181

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2CCCCC2.C1=CC=C(C=C1)P(=S)(O)OCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(CC1)NC2CCCCC2.C1=CC=C(C=C1)P(=S)(O)OCCNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N2O6PS2.C12H23N/c17-16(18)12-6-8-14(9-7-12)25(20,21)15-10-11-22-23(19,24)13-4-2-1-3-5-13;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1-9,15H,10-11H2,(H,19,24);11-13H,1-10H2