N-[(1S,2S,5S)-2-azido-5-phenylmethoxy-cyclohexyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[(1S,2S,5S)-2-azido-5-phenylmethoxy-cyclohexyl]-4-methyl-benzenesulfonamide Openeye Name: N-[(1S,2S,5S)-2-azido-5-benzyloxy-cyclohexyl]-4-methyl-benzenesulfonamide CAS Name: N-[(1S,2S,5S)-2-azido-5-phenylmethoxycyclohexyl]-4-methylbenzenesulfonamide IUPAC Name: N-[(1S,2S,5S)-2-azido-5-phenylmethoxycyclohexyl]-4-methylbenzenesulfonamide Traditional Name: N-[(1S,2S,5S)-2-azido-5-benzoxy-cyclohexyl]-4-methyl-benzenesulfonamide Formula: C20H24N4O3S MolecularWeight: 400.49456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2CC(CCC2N=[N+]=[N-])OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@H]2C[C@H](CC[C@@H]2N=[N+]=[N-])OCC3=CC=CC=C3

InChI

InChI=1S/C20H24N4O3S/c1-15-7-10-18(11-8-15)28(25,26)23-20-13-17(9-12-19(20)22-24-21)27-14-16-5-3-2-4-6-16/h2-8,10-11,17,19-20,23H,9,12-14H2,1H3/t17-,19-,20-/m0/s1