2-pyridin-4-ylpropan-2-yl 7-bromanyl-3-oxidanyl-naphthalene-2-carboxylate

Systemtic Name: 2-pyridin-4-ylpropan-2-yl 7-bromanyl-3-oxidanyl-naphthalene-2-carboxylate Openeye Name: [1-methyl-1-(4-pyridyl)ethyl] 7-bromo-3-hydroxy-naphthalene-2-carboxylate CAS Name: 7-bromo-3-hydroxy-2-naphthalenecarboxylic acid 2-pyridin-4-ylpropan-2-yl ester IUPAC Name: 2-pyridin-4-ylpropan-2-yl 7-bromo-3-hydroxynaphthalene-2-carboxylate Traditional Name: 7-bromo-3-hydroxy-naphthalene-2-carboxylic acid [1-methyl-1-(4-pyridyl)ethyl] ester Formula: C19H16BrNO3 MolecularWeight: 386.23924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=NC=C1)OC(=O)C2=C(C=C3C=CC(=CC3=C2)Br)O

Isomeric SMILES

CC(C)(C1=CC=NC=C1)OC(=O)C2=C(C=C3C=CC(=CC3=C2)Br)O

InChI

InChI=1S/C19H16BrNO3/c1-19(2,14-5-7-21-8-6-14)24-18(23)16-10-13-9-15(20)4-3-12(13)11-17(16)22/h3-11,22H,1-2H3