1-[(2S)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-oxidanylidene-propan-2-yl]pyridin-1-ium-3-carboxamide

Systemtic Name: 1-[(2S)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-oxidanylidene-propan-2-yl]pyridin-1-ium-3-carboxamide Openeye Name: 1-[(1S)-1-methyl-2-[(2S)-2-methylindolin-1-yl]-2-oxo-ethyl]pyridin-1-ium-3-carboxamide CAS Name: 1-[(2S)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-oxopropan-2-yl]-3-pyridin-1-iumcarboxamide IUPAC Name: 1-[(2S)-1-[(2S)-2-methyl-2,3-dihydroindol-1-yl]-1-oxopropan-2-yl]pyridin-1-ium-3-carboxamide Traditional Name: 1-[(1S)-2-keto-1-methyl-2-[(2S)-2-methylindolin-1-yl]ethyl]pyridin-1-ium-3-carboxamide Formula: C18H20N3O2+ MolecularWeight: 310.3703

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C(C)[N+]3=CC=CC(=C3)C(=O)N

Isomeric SMILES

C[C@H]1CC2=CC=CC=C2N1C(=O)[C@H](C)[N+]3=CC=CC(=C3)C(=O)N

InChI

InChI=1S/C18H19N3O2/c1-12-10-14-6-3-4-8-16(14)21(12)18(23)13(2)20-9-5-7-15(11-20)17(19)22/h3-9,11-13H,10H2,1-2H3,(H-,19,22)/p+1/t12-,13-/m0/s1