2-methyl-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-piperazin-4-ium-1-yl-propan-1-one

Systemtic Name: 2-methyl-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-piperazin-4-ium-1-yl-propan-1-one Openeye Name: 2-methyl-2-[(2S)-2-methylindolin-1-yl]-1-piperazin-4-ium-1-yl-propan-1-one CAS Name: 2-methyl-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-(1-piperazin-4-iumyl)-1-propanone IUPAC Name: 2-methyl-2-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-piperazin-4-ium-1-ylpropan-1-one Traditional Name: 2-methyl-2-[(2S)-2-methylindolin-1-yl]-1-piperazin-4-ium-1-yl-propan-1-one Formula: C17H26N3O+ MolecularWeight: 288.40784

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(C)(C)C(=O)N3CC[NH2+]CC3

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(C)(C)C(=O)N3CC[NH2+]CC3

InChI

InChI=1S/C17H25N3O/c1-13-12-14-6-4-5-7-15(14)20(13)17(2,3)16(21)19-10-8-18-9-11-19/h4-7,13,18H,8-12H2,1-3H3/p+1/t13-/m0/s1