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

Systemtic Name: methyl 1-[[5-bromanyl-2-(cyclopentylmethoxy)phenyl]methyl]-6-(ethylamino)-2H-pyridine-3-carboxylate Openeye Name: methyl 1-[[5-bromo-2-(cyclopentylmethoxy)phenyl]methyl]-6-(ethylamino)-2H-pyridine-3-carboxylate CAS Name: 1-[[5-bromo-2-(cyclopentylmethoxy)phenyl]methyl]-6-(ethylamino)-2H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 1-[[5-bromo-2-(cyclopentylmethoxy)phenyl]methyl]-6-(ethylamino)-2H-pyridine-3-carboxylate Traditional Name: 1-[5-bromo-2-(cyclopentylmethoxy)benzyl]-6-(ethylamino)-2H-pyridine-3-carboxylic acid methyl ester Formula: C22H29BrN2O3 MolecularWeight: 449.38126

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC=C(CN1CC2=C(C=CC(=C2)Br)OCC3CCCC3)C(=O)OC

Isomeric SMILES

CCNC1=CC=C(CN1CC2=C(C=CC(=C2)Br)OCC3CCCC3)C(=O)OC

InChI

InChI=1S/C22H29BrN2O3/c1-3-24-21-11-8-17(22(26)27-2)13-25(21)14-18-12-19(23)9-10-20(18)28-15-16-6-4-5-7-16/h8-12,16,24H,3-7,13-15H2,1-2H3