3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(3S)-2-oxidanylidene-1,3-dihydroindol-3-yl]azanium

Systemtic Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(3S)-2-oxidanylidene-1,3-dihydroindol-3-yl]azanium Openeye Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(3S)-2-oxoindolin-3-yl]ammonium CAS Name: 3-[(2S)-2-methyl-1-piperidin-1-iumyl]propyl-[(3S)-2-oxo-1,3-dihydroindol-3-yl]ammonium IUPAC Name: 3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl-[(3S)-2-oxo-1,3-dihydroindol-3-yl]azanium Traditional Name: [(3S)-2-ketoindolin-3-yl]-[3-[(2S)-2-methylpiperidin-1-ium-1-yl]propyl]ammonium Formula: C17H27N3O+2 MolecularWeight: 289.41578

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CCC[NH2+]C2C3=CC=CC=C3NC2=O

Isomeric SMILES

C[C@H]1CCCC[NH+]1CCC[NH2+][C@H]2C3=CC=CC=C3NC2=O

InChI

InChI=1S/C17H25N3O/c1-13-7-4-5-11-20(13)12-6-10-18-16-14-8-2-3-9-15(14)19-17(16)21/h2-3,8-9,13,16,18H,4-7,10-12H2,1H3,(H,19,21)/p+2/t13-,16-/m0/s1