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

Systemtic Name: 1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-3-piperidin-1-ium-1-yl-propan-1-one Openeye Name: 1-[(2S)-2-methylindolin-1-yl]-3-piperidin-1-ium-1-yl-propan-1-one CAS Name: 1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-3-(1-piperidin-1-iumyl)-1-propanone IUPAC Name: 1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-3-piperidin-1-ium-1-ylpropan-1-one Traditional Name: 1-[(2S)-2-methylindolin-1-yl]-3-piperidin-1-ium-1-yl-propan-1-one Formula: C17H25N2O+ MolecularWeight: 273.3932

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)CC[NH+]3CCCCC3

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=O)CC[NH+]3CCCCC3

InChI

InChI=1S/C17H24N2O/c1-14-13-15-7-3-4-8-16(15)19(14)17(20)9-12-18-10-5-2-6-11-18/h3-4,7-8,14H,2,5-6,9-13H2,1H3/p+1/t14-/m0/s1