tert-butyl 4-fluoranyl-3-(pyridin-4-ylamino)-1H-indole-2-carboxylate

Systemtic Name: tert-butyl 4-fluoranyl-3-(pyridin-4-ylamino)-1H-indole-2-carboxylate Openeye Name: tert-butyl 4-fluoro-3-(4-pyridylamino)-1H-indole-2-carboxylate CAS Name: 4-fluoro-3-(pyridin-4-ylamino)-1H-indole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-fluoro-3-(pyridin-4-ylamino)-1H-indole-2-carboxylate Traditional Name: 4-fluoro-3-(4-pyridylamino)-1H-indole-2-carboxylic acid tert-butyl ester Formula: C18H18FN3O2 MolecularWeight: 327.352823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C2=C(N1)C=CC=C2F)NC3=CC=NC=C3

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C2=C(N1)C=CC=C2F)NC3=CC=NC=C3

InChI

InChI=1S/C18H18FN3O2/c1-18(2,3)24-17(23)16-15(21-11-7-9-20-10-8-11)14-12(19)5-4-6-13(14)22-16/h4-10,22H,1-3H3,(H,20,21)