N-[3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide

Systemtic Name: N-[3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]benzenesulfonamide Openeye Name: N-[3-(4-benzhydrylpiperazin-4-ium-1-yl)-3-oxo-propyl]benzenesulfonamide CAS Name: N-[3-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-3-oxopropyl]benzenesulfonamide IUPAC Name: N-[3-(4-benzhydrylpiperazin-4-ium-1-yl)-3-oxopropyl]benzenesulfonamide Traditional Name: N-[3-(4-benzhydrylpiperazin-4-ium-1-yl)-3-keto-propyl]benzenesulfonamide Formula: C26H30N3O3S+ MolecularWeight: 464.5997

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCNS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)CCNS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3S/c30-25(16-17-27-33(31,32)24-14-8-3-9-15-24)28-18-20-29(21-19-28)26(22-10-4-1-5-11-22)23-12-6-2-7-13-23/h1-15,26-27H,16-21H2/p+1