tert-butyl 2-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-c]pyridine-1-carboxylate

Systemtic Name: tert-butyl 2-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-c]pyridine-1-carboxylate Openeye Name: tert-butyl 2-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-c]pyridine-1-carboxylate CAS Name: 2-[4-(trifluoromethyl)phenyl]-1-pyrrolo[2,3-c]pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-c]pyridine-1-carboxylate Traditional Name: 2-[4-(trifluoromethyl)phenyl]pyrrolo[2,3-c]pyridine-1-carboxylic acid tert-butyl ester Formula: C19H17F3N2O2 MolecularWeight: 362.34569

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(=CC2=C1C=NC=C2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)(C)OC(=O)N1C(=CC2=C1C=NC=C2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H17F3N2O2/c1-18(2,3)26-17(25)24-15(10-13-8-9-23-11-16(13)24)12-4-6-14(7-5-12)19(20,21)22/h4-11H,1-3H3