4-[2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium-1-yl]ethanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium-1-yl]ethanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[4-[(E)-styryl]sulfonylpiperazin-1-ium-1-yl]acetyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[1-oxo-2-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazin-1-iumyl]ethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-ium-1-yl]acetyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-[4-[(E)-styryl]sulfonylpiperazin-1-ium-1-yl]acetyl]-1,3-dihydroquinoxalin-2-one Formula: C22H25N4O4S+ MolecularWeight: 441.5233

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N2CC(=O)NC3=CC=CC=C32)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N2CC(=O)NC3=CC=CC=C32)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O4S/c27-21-16-26(20-9-5-4-8-19(20)23-21)22(28)17-24-11-13-25(14-12-24)31(29,30)15-10-18-6-2-1-3-7-18/h1-10,15H,11-14,16-17H2,(H,23,27)/p+1/b15-10+