5-[(3-bromanyl-5-methyl-pyridin-2-yl)carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate

Systemtic Name: 5-[(3-bromanyl-5-methyl-pyridin-2-yl)carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate Openeye Name: 5-[(3-bromo-5-methyl-2-pyridyl)carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate CAS Name: 5-[[(3-bromo-5-methyl-2-pyridinyl)amino]-oxomethyl]-3,6-dihydro-2H-pyridine-1-carboxylate IUPAC Name: 5-[(3-bromo-5-methylpyridin-2-yl)carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate Traditional Name: 5-[(3-bromo-5-methyl-2-pyridyl)carbamoyl]-3,6-dihydro-2H-pyridine-1-carboxylate Formula: C13H13BrN3O3- MolecularWeight: 339.16462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N=C1)NC(=O)C2=CCCN(C2)C(=O)[O-])Br

Isomeric SMILES

CC1=CC(=C(N=C1)NC(=O)C2=CCCN(C2)C(=O)[O-])Br

InChI

InChI=1S/C13H14BrN3O3/c1-8-5-10(14)11(15-6-8)16-12(18)9-3-2-4-17(7-9)13(19)20/h3,5-6H,2,4,7H2,1H3,(H,19,20)(H,15,16,18)/p-1