tert-butyl N-[4-[1-bromanyl-2-(2-methylphenyl)-2-oxidanylidene-ethyl]pyridin-2-yl]carbamate hydrobromide

Systemtic Name: tert-butyl N-[4-[1-bromanyl-2-(2-methylphenyl)-2-oxidanylidene-ethyl]pyridin-2-yl]carbamate hydrobromide Openeye Name: tert-butyl N-[4-[1-bromo-2-(o-tolyl)-2-oxo-ethyl]-2-pyridyl]carbamate hydrobromide CAS Name: N-[4-[1-bromo-2-(2-methylphenyl)-2-oxoethyl]-2-pyridinyl]carbamic acid tert-butyl ester hydrobromide IUPAC Name: tert-butyl N-[4-[1-bromo-2-(2-methylphenyl)-2-oxoethyl]pyridin-2-yl]carbamate hydrobromide Traditional Name: N-[4-[1-bromo-2-keto-2-(o-tolyl)ethyl]-2-pyridyl]carbamic acid tert-butyl ester hydrobromide Formula: C19H22Br2N2O3 MolecularWeight: 486.19758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C(C2=CC(=NC=C2)NC(=O)OC(C)(C)C)Br.Br

Isomeric SMILES

CC1=CC=CC=C1C(=O)C(C2=CC(=NC=C2)NC(=O)OC(C)(C)C)Br.Br

InChI

InChI=1S/C19H21BrN2O3.BrH/c1-12-7-5-6-8-14(12)17(23)16(20)13-9-10-21-15(11-13)22-18(24)25-19(2,3)4;/h5-11,16H,1-4H3,(H,21,22,24);1H