2-nitro-N-[3-(3-propan-2-yloxyphenyl)propyl]benzenesulfonamide

Systemtic Name: 2-nitro-N-[3-(3-propan-2-yloxyphenyl)propyl]benzenesulfonamide Openeye Name: N-[3-(3-isopropoxyphenyl)propyl]-2-nitro-benzenesulfonamide CAS Name: 2-nitro-N-[3-(3-propan-2-yloxyphenyl)propyl]benzenesulfonamide IUPAC Name: 2-nitro-N-[3-(3-propan-2-yloxyphenyl)propyl]benzenesulfonamide Traditional Name: N-[3-(3-isopropoxyphenyl)propyl]-2-nitro-benzenesulfonamide Formula: C18H22N2O5S MolecularWeight: 378.44268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)CCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)CCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O5S/c1-14(2)25-16-9-5-7-15(13-16)8-6-12-19-26(23,24)18-11-4-3-10-17(18)20(21)22/h3-5,7,9-11,13-14,19H,6,8,12H2,1-2H3