methylsulfonyl-[2-[[(1S)-1-(4-propan-2-yloxyphenyl)ethyl]azaniumyl]ethyl]azanide

Systemtic Name: methylsulfonyl-[2-[[(1S)-1-(4-propan-2-yloxyphenyl)ethyl]azaniumyl]ethyl]azanide Openeye Name: 2-[[(1S)-1-(4-isopropoxyphenyl)ethyl]ammonio]ethyl-methylsulfonyl-azanide CAS Name: methylsulfonyl-[2-[[(1S)-1-(4-propan-2-yloxyphenyl)ethyl]ammonio]ethyl]azanide IUPAC Name: methylsulfonyl-[2-[[(1S)-1-(4-propan-2-yloxyphenyl)ethyl]azaniumyl]ethyl]azanide Traditional Name: 2-[[(1S)-1-(4-isopropoxyphenyl)ethyl]ammonio]ethyl-mesyl-azanide Formula: C14H24N2O3S MolecularWeight: 300.41696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)C(C)[NH2+]CC[N-]S(=O)(=O)C

Isomeric SMILES

C[C@@H](C1=CC=C(C=C1)OC(C)C)[NH2+]CC[N-]S(=O)(=O)C

InChI

InChI=1S/C14H23N2O3S/c1-11(2)19-14-7-5-13(6-8-14)12(3)15-9-10-16-20(4,17)18/h5-8,11-12,15H,9-10H2,1-4H3/q-1/p+1/t12-/m0/s1