methyl 1-[(5-bromanyl-2-oxidanyl-phenyl)methyl]-6-(ethylamino)-2H-pyridine-3-carboxylate

Systemtic Name: methyl 1-[(5-bromanyl-2-oxidanyl-phenyl)methyl]-6-(ethylamino)-2H-pyridine-3-carboxylate Openeye Name: methyl 1-[(5-bromo-2-hydroxy-phenyl)methyl]-6-(ethylamino)-2H-pyridine-3-carboxylate CAS Name: 1-[(5-bromo-2-hydroxyphenyl)methyl]-6-(ethylamino)-2H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 1-[(5-bromo-2-hydroxyphenyl)methyl]-6-(ethylamino)-2H-pyridine-3-carboxylate Traditional Name: 1-(5-bromo-2-hydroxy-benzyl)-6-(ethylamino)-2H-pyridine-3-carboxylic acid methyl ester Formula: C16H19BrN2O3 MolecularWeight: 367.23766

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC=C(CN1CC2=C(C=CC(=C2)Br)O)C(=O)OC

Isomeric SMILES

CCNC1=CC=C(CN1CC2=C(C=CC(=C2)Br)O)C(=O)OC

InChI

InChI=1S/C16H19BrN2O3/c1-3-18-15-7-4-11(16(21)22-2)9-19(15)10-12-8-13(17)5-6-14(12)20/h4-8,18,20H,3,9-10H2,1-2H3