N,N-bis(phenylmethyl)-4-(1,4,7-triazonan-1-ylmethyl)benzenesulfonamide

Systemtic Name: N,N-bis(phenylmethyl)-4-(1,4,7-triazonan-1-ylmethyl)benzenesulfonamide Openeye Name: N,N-dibenzyl-4-(1,4,7-triazonan-1-ylmethyl)benzenesulfonamide CAS Name: N,N-bis(phenylmethyl)-4-(1,4,7-triazonan-1-ylmethyl)benzenesulfonamide IUPAC Name: N,N-dibenzyl-4-(1,4,7-triazonan-1-ylmethyl)benzenesulfonamide Traditional Name: N,N-dibenzyl-4-(1,4,7-triazonan-1-ylmethyl)benzenesulfonamide Formula: C27H34N4O2S MolecularWeight: 478.64946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(CCN1)CC2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

C1CNCCN(CCN1)CC2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H34N4O2S/c32-34(33,31(22-24-7-3-1-4-8-24)23-25-9-5-2-6-10-25)27-13-11-26(12-14-27)21-30-19-17-28-15-16-29-18-20-30/h1-14,28-29H,15-23H2