tert-butyl 3-[3,4-bis(fluoranyl)phenyl]-4-(hydroxymethyl)indole-1-carboxylate

Systemtic Name: tert-butyl 3-[3,4-bis(fluoranyl)phenyl]-4-(hydroxymethyl)indole-1-carboxylate Openeye Name: tert-butyl 3-(3,4-difluorophenyl)-4-(hydroxymethyl)indole-1-carboxylate CAS Name: 3-(3,4-difluorophenyl)-4-(hydroxymethyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-(3,4-difluorophenyl)-4-(hydroxymethyl)indole-1-carboxylate Traditional Name: 3-(3,4-difluorophenyl)-4-methylol-indole-1-carboxylic acid tert-butyl ester Formula: C20H19F2NO3 MolecularWeight: 359.366566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=C(C=CC=C21)CO)C3=CC(=C(C=C3)F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=C(C=CC=C21)CO)C3=CC(=C(C=C3)F)F

InChI

InChI=1S/C20H19F2NO3/c1-20(2,3)26-19(25)23-10-14(12-7-8-15(21)16(22)9-12)18-13(11-24)5-4-6-17(18)23/h4-10,24H,11H2,1-3H3