4-[2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanoyl]-1,3-dihydroquinoxalin-2-one

Systemtic Name: 4-[2-[4-(phenylsulfonyl)piperazin-1-ium-1-yl]ethanoyl]-1,3-dihydroquinoxalin-2-one Openeye Name: 4-[2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]acetyl]-1,3-dihydroquinoxalin-2-one CAS Name: 4-[2-[4-(benzenesulfonyl)-1-piperazin-1-iumyl]-1-oxoethyl]-1,3-dihydroquinoxalin-2-one IUPAC Name: 4-[2-[4-(benzenesulfonyl)piperazin-1-ium-1-yl]acetyl]-1,3-dihydroquinoxalin-2-one Traditional Name: 4-[2-(4-besylpiperazin-1-ium-1-yl)acetyl]-1,3-dihydroquinoxalin-2-one Formula: C20H23N4O4S+ MolecularWeight: 415.48602

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O4S/c25-19-14-24(18-9-5-4-8-17(18)21-19)20(26)15-22-10-12-23(13-11-22)29(27,28)16-6-2-1-3-7-16/h1-9H,10-15H2,(H,21,25)/p+1