(2R)-3-phenyl-2-[4-(piperidin-1-yldiazenyl)phenyl]sulfonylazanidyl-propanoate

Systemtic Name: (2R)-3-phenyl-2-[4-(piperidin-1-yldiazenyl)phenyl]sulfonylazanidyl-propanoate Openeye Name: (2R)-3-phenyl-2-[4-(1-piperidylazo)phenyl]sulfonylazanidyl-propanoate CAS Name: (2R)-3-phenyl-2-[4-(1-piperidinylazo)phenyl]sulfonylazanidylpropanoate IUPAC Name: (2R)-3-phenyl-2-[4-(piperidin-1-yldiazenyl)phenyl]sulfonylazanidylpropanoate Traditional Name: (2R)-3-phenyl-2-(4-piperidinoazophenyl)sulfonylazanidyl-propionate Formula: C20H22N4O4S-2 MolecularWeight: 414.47808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)N=NC2=CC=C(C=C2)S(=O)(=O)[N-]C(CC3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

C1CCN(CC1)N=NC2=CC=C(C=C2)S(=O)(=O)[N-][C@H](CC3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C20H23N4O4S/c25-20(26)19(15-16-7-3-1-4-8-16)22-29(27,28)18-11-9-17(10-12-18)21-23-24-13-5-2-6-14-24/h1,3-4,7-12,19H,2,5-6,13-15H2,(H,25,26)/q-1/p-1/t19-/m1/s1