pentyl 4-[(5-bromanylpyridin-3-yl)carbonylamino]benzoate

Systemtic Name: pentyl 4-[(5-bromanylpyridin-3-yl)carbonylamino]benzoate Openeye Name: pentyl 4-[(5-bromopyridine-3-carbonyl)amino]benzoate CAS Name: 4-[[(5-bromo-3-pyridinyl)-oxomethyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[(5-bromopyridine-3-carbonyl)amino]benzoate Traditional Name: 4-[(5-bromonicotinoyl)amino]benzoic acid amyl ester Formula: C18H19BrN2O3 MolecularWeight: 391.25906

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C18H19BrN2O3/c1-2-3-4-9-24-18(23)13-5-7-16(8-6-13)21-17(22)14-10-15(19)12-20-11-14/h5-8,10-12H,2-4,9H2,1H3,(H,21,22)