N4,N4-diethyl-N1-methyl-N1-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzene-1,4-disulfonamide

Systemtic Name: N4,N4-diethyl-N1-methyl-N1-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzene-1,4-disulfonamide Openeye Name: N4,N4-diethyl-N1-methyl-N1-[(1S)-tetralin-1-yl]benzene-1,4-disulfonamide CAS Name: N4,N4-diethyl-N1-methyl-N1-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzene-1,4-disulfonamide IUPAC Name: 4-N,4-N-diethyl-1-N-methyl-1-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]benzene-1,4-disulfonamide Traditional Name: N',N'-diethyl-N-methyl-N-[(1S)-tetralin-1-yl]benzene-1,4-disulfonamide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)C2CCCC3=CC=CC=C23

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)[C@H]2CCCC3=CC=CC=C23

InChI

InChI=1S/C21H28N2O4S2/c1-4-23(5-2)29(26,27)19-15-13-18(14-16-19)28(24,25)22(3)21-12-8-10-17-9-6-7-11-20(17)21/h6-7,9,11,13-16,21H,4-5,8,10,12H2,1-3H3/t21-/m0/s1