N-[4-[4-[(4-cyanophenyl)methyl]piperazin-4-ium-1-yl]-4-oxidanylidene-butyl]-4-methoxy-N-methyl-benzenesulfonamide

Systemtic Name: N-[4-[4-[(4-cyanophenyl)methyl]piperazin-4-ium-1-yl]-4-oxidanylidene-butyl]-4-methoxy-N-methyl-benzenesulfonamide Openeye Name: N-[4-[4-[(4-cyanophenyl)methyl]piperazin-4-ium-1-yl]-4-oxo-butyl]-4-methoxy-N-methyl-benzenesulfonamide CAS Name: N-[4-[4-[(4-cyanophenyl)methyl]-1-piperazin-4-iumyl]-4-oxobutyl]-4-methoxy-N-methylbenzenesulfonamide IUPAC Name: N-[4-[4-[(4-cyanophenyl)methyl]piperazin-4-ium-1-yl]-4-oxobutyl]-4-methoxy-N-methylbenzenesulfonamide Traditional Name: N-[4-[4-(4-cyanobenzyl)piperazin-4-ium-1-yl]-4-keto-butyl]-4-methoxy-N-methyl-benzenesulfonamide Formula: C24H31N4O4S+ MolecularWeight: 471.59234

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)N1CC[NH+](CC1)CC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CN(CCCC(=O)N1CC[NH+](CC1)CC2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H30N4O4S/c1-26(33(30,31)23-11-9-22(32-2)10-12-23)13-3-4-24(29)28-16-14-27(15-17-28)19-21-7-5-20(18-25)6-8-21/h5-12H,3-4,13-17,19H2,1-2H3/p+1