(2S)-1-(2,3-dihydroindol-1-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propan-1-one

Systemtic Name: (2S)-1-(2,3-dihydroindol-1-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propan-1-one Openeye Name: (2S)-1-indolin-1-yl-2-(4-methylpiperazine-1,4-diium-1-yl)propan-1-one CAS Name: (2S)-1-(2,3-dihydroindol-1-yl)-2-(4-methyl-1-piperazine-1,4-diiumyl)-1-propanone IUPAC Name: (2S)-1-(2,3-dihydroindol-1-yl)-2-(4-methylpiperazine-1,4-diium-1-yl)propan-1-one Traditional Name: (2S)-1-indolin-1-yl-2-(4-methylpiperazine-1,4-diium-1-yl)propan-1-one Formula: C16H25N3O+2 MolecularWeight: 275.3892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=CC=CC=C21)[NH+]3CC[NH+](CC3)C

Isomeric SMILES

C[C@@H](C(=O)N1CCC2=CC=CC=C21)[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C16H23N3O/c1-13(18-11-9-17(2)10-12-18)16(20)19-8-7-14-5-3-4-6-15(14)19/h3-6,13H,7-12H2,1-2H3/p+2/t13-/m0/s1