tert-butyl N-[4-(2-bromanyl-5-methoxy-phenyl)-6-(tert-butylcarbamoyl)pyridin-3-yl]carbamate

Systemtic Name: tert-butyl N-[4-(2-bromanyl-5-methoxy-phenyl)-6-(tert-butylcarbamoyl)pyridin-3-yl]carbamate Openeye Name: tert-butyl N-[4-(2-bromo-5-methoxy-phenyl)-6-(tert-butylcarbamoyl)-3-pyridyl]carbamate CAS Name: N-[4-(2-bromo-5-methoxyphenyl)-6-[(tert-butylamino)-oxomethyl]-3-pyridinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-(2-bromo-5-methoxyphenyl)-6-(tert-butylcarbamoyl)pyridin-3-yl]carbamate Traditional Name: N-[4-(2-bromo-5-methoxy-phenyl)-6-(tert-butylcarbamoyl)-3-pyridyl]carbamic acid tert-butyl ester Formula: C22H28BrN3O4 MolecularWeight: 478.37942

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=NC=C(C(=C1)C2=C(C=CC(=C2)OC)Br)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)NC(=O)C1=NC=C(C(=C1)C2=C(C=CC(=C2)OC)Br)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H28BrN3O4/c1-21(2,3)26-19(27)17-11-15(14-10-13(29-7)8-9-16(14)23)18(12-24-17)25-20(28)30-22(4,5)6/h8-12H,1-7H3,(H,25,28)(H,26,27)