tert-butyl 1-(hydroxymethyl)-2,3-dihydroindol-1-ium-1-carboxylate

Systemtic Name: tert-butyl 1-(hydroxymethyl)-2,3-dihydroindol-1-ium-1-carboxylate Openeye Name: tert-butyl 1-(hydroxymethyl)indolin-1-ium-1-carboxylate CAS Name: 1-(hydroxymethyl)-2,3-dihydroindol-1-ium-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 1-(hydroxymethyl)-2,3-dihydroindol-1-ium-1-carboxylate Traditional Name: 1-methylolindolin-1-ium-1-carboxylic acid tert-butyl ester Formula: C14H20NO3+ MolecularWeight: 250.3135

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)[N+]1(CCC2=CC=CC=C21)CO

Isomeric SMILES

CC(C)(C)OC(=O)[N+]1(CCC2=CC=CC=C21)CO

InChI

InChI=1S/C14H20NO3/c1-14(2,3)18-13(17)15(10-16)9-8-11-6-4-5-7-12(11)15/h4-7,16H,8-10H2,1-3H3/q+1