methyl 6-[[5-bromanyl-2-(2-chloranylprop-2-enoxy)phenyl]methyl-ethyl-amino]pyridine-3-carboxylate

Systemtic Name: methyl 6-[[5-bromanyl-2-(2-chloranylprop-2-enoxy)phenyl]methyl-ethyl-amino]pyridine-3-carboxylate Openeye Name: methyl 6-[[5-bromo-2-(2-chloroallyloxy)phenyl]methyl-ethyl-amino]pyridine-3-carboxylate CAS Name: 6-[[5-bromo-2-(2-chloroprop-2-enoxy)phenyl]methyl-ethylamino]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[[5-bromo-2-(2-chloroprop-2-enoxy)phenyl]methyl-ethylamino]pyridine-3-carboxylate Traditional Name: 6-[[5-bromo-2-(2-chloroallyloxy)benzyl]-ethyl-amino]nicotinic acid methyl ester Formula: C19H20BrClN2O3 MolecularWeight: 439.7307

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrClN2O3/c1-4-23(18-8-5-14(10-22-18)19(24)25-3)11-15-9-16(20)6-7-17(15)26-12-13(2)21/h5-10H,2,4,11-12H2,1,3H3