potassium N-(phenylmethyl)-N-[(2S)-1-phenyl-3-selenocyanato-propan-2-yl]sulfamate

Systemtic Name: potassium N-(phenylmethyl)-N-[(2S)-1-phenyl-3-selenocyanato-propan-2-yl]sulfamate Openeye Name: potassium N-benzyl-N-[(1S)-1-benzyl-2-selenocyanato-ethyl]sulfamate CAS Name: potassium N-(phenylmethyl)-N-[(2S)-1-phenyl-3-selenocyanatopropan-2-yl]sulfamate IUPAC Name: potassium N-benzyl-N-[(2S)-1-phenyl-3-selenocyanatopropan-2-yl]sulfamate Traditional Name: potassium N-benzyl-N-[(1S)-1-benzyl-2-selenocyanato-ethyl]sulfamate Formula: C17H17KN2O3SSe MolecularWeight: 447.45178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C[Se]C#N)N(CC2=CC=CC=C2)S(=O)(=O)[O-].[K+]

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C[Se]C#N)N(CC2=CC=CC=C2)S(=O)(=O)[O-].[K+]

InChI

InChI=1S/C17H18N2O3SSe.K/c18-14-24-13-17(11-15-7-3-1-4-8-15)19(23(20,21)22)12-16-9-5-2-6-10-16;/h1-10,17H,11-13H2,(H,20,21,22);/q;+1/p-1/t17-;/m0./s1