4-ethoxy-N-(4-methylphenyl)-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]benzenesulfonamide

Systemtic Name: 4-ethoxy-N-(4-methylphenyl)-N-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]benzenesulfonamide Openeye Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-4-ethoxy-N-(p-tolyl)benzenesulfonamide CAS Name: 4-ethoxy-N-(4-methylphenyl)-N-[2-oxo-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]benzenesulfonamide IUPAC Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-oxoethyl]-4-ethoxy-N-(4-methylphenyl)benzenesulfonamide Traditional Name: N-[2-(4-benzylpiperazin-4-ium-1-yl)-2-keto-ethyl]-4-ethoxy-N-(p-tolyl)benzenesulfonamide Formula: C28H34N3O4S+ MolecularWeight: 508.65226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3)C4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)N2CC[NH+](CC2)CC3=CC=CC=C3)C4=CC=C(C=C4)C

InChI

InChI=1S/C28H33N3O4S/c1-3-35-26-13-15-27(16-14-26)36(33,34)31(25-11-9-23(2)10-12-25)22-28(32)30-19-17-29(18-20-30)21-24-7-5-4-6-8-24/h4-16H,3,17-22H2,1-2H3/p+1