6-[[(1S)-1-(2-bromophenyl)ethyl]carbamoyl]pyridazin-3-olate

Systemtic Name: 6-[[(1S)-1-(2-bromophenyl)ethyl]carbamoyl]pyridazin-3-olate Openeye Name: 6-[[(1S)-1-(2-bromophenyl)ethyl]carbamoyl]pyridazin-3-olate CAS Name: 6-[[[(1S)-1-(2-bromophenyl)ethyl]amino]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[[(1S)-1-(2-bromophenyl)ethyl]carbamoyl]pyridazin-3-olate Traditional Name: 6-[[(1S)-1-(2-bromophenyl)ethyl]carbamoyl]pyridazin-3-olate Formula: C13H11BrN3O2- MolecularWeight: 321.14934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1Br)NC(=O)C2=NN=C(C=C2)[O-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1Br)NC(=O)C2=NN=C(C=C2)[O-]

InChI

InChI=1S/C13H12BrN3O2/c1-8(9-4-2-3-5-10(9)14)15-13(19)11-6-7-12(18)17-16-11/h2-8H,1H3,(H,15,19)(H,17,18)/p-1/t8-/m0/s1