1-[5-[4-[(5-methylfuran-2-yl)methyl]piperazin-4-ium-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone

Systemtic Name: 1-[5-[4-[(5-methylfuran-2-yl)methyl]piperazin-4-ium-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone Openeye Name: 1-[5-[4-[(5-methyl-2-furyl)methyl]piperazin-4-ium-1-yl]sulfonylindolin-1-yl]ethanone CAS Name: 1-[5-[[4-[(5-methyl-2-furanyl)methyl]-1-piperazin-4-iumyl]sulfonyl]-2,3-dihydroindol-1-yl]ethanone IUPAC Name: 1-[5-[4-[(5-methylfuran-2-yl)methyl]piperazin-4-ium-1-yl]sulfonyl-2,3-dihydroindol-1-yl]ethanone Traditional Name: 1-[5-[4-[(5-methyl-2-furyl)methyl]piperazin-4-ium-1-yl]sulfonylindolin-1-yl]ethanone Formula: C20H26N3O4S+ MolecularWeight: 404.50314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)N(CC4)C(=O)C

Isomeric SMILES

CC1=CC=C(O1)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)N(CC4)C(=O)C

InChI

InChI=1S/C20H25N3O4S/c1-15-3-4-18(27-15)14-21-9-11-22(12-10-21)28(25,26)19-5-6-20-17(13-19)7-8-23(20)16(2)24/h3-6,13H,7-12,14H2,1-2H3/p+1