3,3-dimethyl-4-[2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoyl]-1H-quinoxalin-2-one

Systemtic Name: 3,3-dimethyl-4-[2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoyl]-1H-quinoxalin-2-one Openeye Name: 3,3-dimethyl-4-[2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]-1H-quinoxalin-2-one CAS Name: 3,3-dimethyl-4-[1-oxo-2-[4-(4-propylphenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]-1H-quinoxalin-2-one IUPAC Name: 3,3-dimethyl-4-[2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]-1H-quinoxalin-2-one Traditional Name: 3,3-dimethyl-4-[2-[4-(4-propylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]-1H-quinoxalin-2-one Formula: C25H33N4O4S+ MolecularWeight: 485.61892

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N3C4=CC=CC=C4NC(=O)C3(C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC(=O)N3C4=CC=CC=C4NC(=O)C3(C)C

InChI

InChI=1S/C25H32N4O4S/c1-4-7-19-10-12-20(13-11-19)34(32,33)28-16-14-27(15-17-28)18-23(30)29-22-9-6-5-8-21(22)26-24(31)25(29,2)3/h5-6,8-13H,4,7,14-18H2,1-3H3,(H,26,31)/p+1