[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 4-bromanyl-3,5-dimethoxy-benzoate

Systemtic Name: [2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl] 4-bromanyl-3,5-dimethoxy-benzoate Openeye Name: [2-[(5-chloro-2-pyridyl)amino]-2-oxo-ethyl] 4-bromo-3,5-dimethoxy-benzoate CAS Name: 4-bromo-3,5-dimethoxybenzoic acid [2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl] 4-bromo-3,5-dimethoxybenzoate Traditional Name: 4-bromo-3,5-dimethoxy-benzoic acid [2-[(5-chloro-2-pyridyl)amino]-2-keto-ethyl] ester Formula: C16H14BrClN2O5 MolecularWeight: 429.64976

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Br)OC)C(=O)OCC(=O)NC2=NC=C(C=C2)Cl

Isomeric SMILES

COC1=CC(=CC(=C1Br)OC)C(=O)OCC(=O)NC2=NC=C(C=C2)Cl

InChI

InChI=1S/C16H14BrClN2O5/c1-23-11-5-9(6-12(24-2)15(11)17)16(22)25-8-14(21)20-13-4-3-10(18)7-19-13/h3-7H,8H2,1-2H3,(H,19,20,21)