6-[[(1S)-1-(4-bromophenyl)propyl]carbamoyl]pyridazin-3-olate

Systemtic Name: 6-[[(1S)-1-(4-bromophenyl)propyl]carbamoyl]pyridazin-3-olate Openeye Name: 6-[[(1S)-1-(4-bromophenyl)propyl]carbamoyl]pyridazin-3-olate CAS Name: 6-[[[(1S)-1-(4-bromophenyl)propyl]amino]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[[(1S)-1-(4-bromophenyl)propyl]carbamoyl]pyridazin-3-olate Traditional Name: 6-[[(1S)-1-(4-bromophenyl)propyl]carbamoyl]pyridazin-3-olate Formula: C14H13BrN3O2- MolecularWeight: 335.17592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14BrN3O2/c1-2-11(9-3-5-10(15)6-4-9)16-14(20)12-7-8-13(19)18-17-12/h3-8,11H,2H2,1H3,(H,16,20)(H,18,19)/p-1/t11-/m0/s1