N4-(2-cyanoethyl)-N1,N4-dicyclohexyl-benzene-1,4-disulfonamide

Systemtic Name: N4-(2-cyanoethyl)-N1,N4-dicyclohexyl-benzene-1,4-disulfonamide Openeye Name: N4-(2-cyanoethyl)-N1,N4-dicyclohexyl-benzene-1,4-disulfonamide CAS Name: N4-(2-cyanoethyl)-N1,N4-dicyclohexylbenzene-1,4-disulfonamide IUPAC Name: 4-N-(2-cyanoethyl)-1-N,4-N-dicyclohexylbenzene-1,4-disulfonamide Traditional Name: N'-(2-cyanoethyl)-N,N'-dicyclohexyl-benzene-1,4-disulfonamide Formula: C21H31N3O4S2 MolecularWeight: 453.61854

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC#N)C3CCCCC3

Isomeric SMILES

C1CCC(CC1)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC#N)C3CCCCC3

InChI

InChI=1S/C21H31N3O4S2/c22-16-7-17-24(19-10-5-2-6-11-19)30(27,28)21-14-12-20(13-15-21)29(25,26)23-18-8-3-1-4-9-18/h12-15,18-19,23H,1-11,17H2