N-tert-butyl-2-[4-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]ethanoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-[2-[(2S)-2-methylindolin-1-yl]acetyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-[2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]acetyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-[2-[(2S)-2-methylindolin-1-yl]acetyl]piperazin-1-ium-1-yl]acetamide Formula: C21H33N4O2+ MolecularWeight: 373.51232

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1CC(=O)N3CC[NH+](CC3)CC(=O)NC(C)(C)C

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1CC(=O)N3CC[NH+](CC3)CC(=O)NC(C)(C)C

InChI

InChI=1S/C21H32N4O2/c1-16-13-17-7-5-6-8-18(17)25(16)15-20(27)24-11-9-23(10-12-24)14-19(26)22-21(2,3)4/h5-8,16H,9-15H2,1-4H3,(H,22,26)/p+1/t16-/m0/s1