2-[4-[3-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]phenyl]carbonylpiperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[3-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]phenyl]carbonylpiperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[3-[(2R)-2-methylindolin-1-yl]sulfonylbenzoyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[[3-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]phenyl]-oxomethyl]-1-piperazin-1-iumyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[3-[[(2R)-2-methyl-2,3-dihydroindol-1-yl]sulfonyl]benzoyl]piperazin-1-ium-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[3-[(2R)-2-methylindolin-1-yl]sulfonylbenzoyl]piperazin-1-ium-1-yl]-1-pyrrolidino-ethanone Formula: C26H33N4O4S+ MolecularWeight: 497.62962

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)N4CC[NH+](CC4)CC(=O)N5CCCC5

Isomeric SMILES

C[C@@H]1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)N4CC[NH+](CC4)CC(=O)N5CCCC5

InChI

InChI=1S/C26H32N4O4S/c1-20-17-21-7-2-3-10-24(21)30(20)35(33,34)23-9-6-8-22(18-23)26(32)29-15-13-27(14-16-29)19-25(31)28-11-4-5-12-28/h2-3,6-10,18,20H,4-5,11-17,19H2,1H3/p+1/t20-/m1/s1