6-[[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]carbamoyl]pyridazin-3-olate

Systemtic Name: 6-[[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]carbamoyl]pyridazin-3-olate Openeye Name: 6-[[(1S)-1-(4-isobutylphenyl)ethyl]carbamoyl]pyridazin-3-olate CAS Name: 6-[[[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]amino]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[[(1S)-1-[4-(2-methylpropyl)phenyl]ethyl]carbamoyl]pyridazin-3-olate Traditional Name: 6-[[(1S)-1-(4-isobutylphenyl)ethyl]carbamoyl]pyridazin-3-olate Formula: C17H20N3O2- MolecularWeight: 298.3596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(C)NC(=O)C2=NN=C(C=C2)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O2/c1-11(2)10-13-4-6-14(7-5-13)12(3)18-17(22)15-8-9-16(21)20-19-15/h4-9,11-12H,10H2,1-3H3,(H,18,22)(H,20,21)/p-1/t12-/m0/s1