N,N-bis(2-ethylhexyl)-4-morpholin-4-yl-3-nitro-benzenesulfonamide

Systemtic Name: N,N-bis(2-ethylhexyl)-4-morpholin-4-yl-3-nitro-benzenesulfonamide Openeye Name: N,N-bis(2-ethylhexyl)-4-morpholino-3-nitro-benzenesulfonamide CAS Name: N,N-bis(2-ethylhexyl)-4-(4-morpholinyl)-3-nitrobenzenesulfonamide IUPAC Name: N,N-bis(2-ethylhexyl)-4-morpholin-4-yl-3-nitrobenzenesulfonamide Traditional Name: N,N-bis(2-ethylhexyl)-4-morpholino-3-nitro-benzenesulfonamide Formula: C26H45N3O5S MolecularWeight: 511.7176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN(CC(CC)CCCC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)[N+](=O)[O-]

Isomeric SMILES

CCCCC(CC)CN(CC(CC)CCCC)S(=O)(=O)C1=CC(=C(C=C1)N2CCOCC2)[N+](=O)[O-]

InChI

InChI=1S/C26H45N3O5S/c1-5-9-11-22(7-3)20-28(21-23(8-4)12-10-6-2)35(32,33)24-13-14-25(26(19-24)29(30)31)27-15-17-34-18-16-27/h13-14,19,22-23H,5-12,15-18,20-21H2,1-4H3