1-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanoyl]-2,3-dihydroindole-5-sulfonamide

Systemtic Name: 1-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]ethanoyl]-2,3-dihydroindole-5-sulfonamide Openeye Name: 1-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]indoline-5-sulfonamide CAS Name: 1-[2-[4-(4-hydroxyphenyl)-1-piperazin-1-iumyl]-1-oxoethyl]-2,3-dihydroindole-5-sulfonamide IUPAC Name: 1-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]-2,3-dihydroindole-5-sulfonamide Traditional Name: 1-[2-[4-(4-hydroxyphenyl)piperazin-1-ium-1-yl]acetyl]indoline-5-sulfonamide Formula: C20H25N4O4S+ MolecularWeight: 417.5019

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=C(C=C2)S(=O)(=O)N)C(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)O

Isomeric SMILES

C1CN(C2=C1C=C(C=C2)S(=O)(=O)N)C(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)O

InChI

InChI=1S/C20H24N4O4S/c21-29(27,28)18-5-6-19-15(13-18)7-8-24(19)20(26)14-22-9-11-23(12-10-22)16-1-3-17(25)4-2-16/h1-6,13,25H,7-12,14H2,(H2,21,27,28)/p+1