tert-butyl N-[4-[1-bromanyl-2-(3,5-dimethylphenyl)-2-oxidanylidene-ethyl]pyridin-2-yl]carbamate

Systemtic Name: tert-butyl N-[4-[1-bromanyl-2-(3,5-dimethylphenyl)-2-oxidanylidene-ethyl]pyridin-2-yl]carbamate Openeye Name: tert-butyl N-[4-[1-bromo-2-(3,5-dimethylphenyl)-2-oxo-ethyl]-2-pyridyl]carbamate CAS Name: N-[4-[1-bromo-2-(3,5-dimethylphenyl)-2-oxoethyl]-2-pyridinyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[1-bromo-2-(3,5-dimethylphenyl)-2-oxoethyl]pyridin-2-yl]carbamate Traditional Name: N-[4-[1-bromo-2-(3,5-dimethylphenyl)-2-keto-ethyl]-2-pyridyl]carbamic acid tert-butyl ester Formula: C20H23BrN2O3 MolecularWeight: 419.31222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)C(C2=CC(=NC=C2)NC(=O)OC(C)(C)C)Br)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)C(C2=CC(=NC=C2)NC(=O)OC(C)(C)C)Br)C

InChI

InChI=1S/C20H23BrN2O3/c1-12-8-13(2)10-15(9-12)18(24)17(21)14-6-7-22-16(11-14)23-19(25)26-20(3,4)5/h6-11,17H,1-5H3,(H,22,23,25)