6-[[(1R)-1-(4-ethylphenyl)-2-methyl-propyl]carbamoyl]pyridazin-3-olate

Systemtic Name: 6-[[(1R)-1-(4-ethylphenyl)-2-methyl-propyl]carbamoyl]pyridazin-3-olate Openeye Name: 6-[[(1R)-1-(4-ethylphenyl)-2-methyl-propyl]carbamoyl]pyridazin-3-olate CAS Name: 6-[[[(1R)-1-(4-ethylphenyl)-2-methylpropyl]amino]-oxomethyl]-3-pyridazinolate IUPAC Name: 6-[[(1R)-1-(4-ethylphenyl)-2-methylpropyl]carbamoyl]pyridazin-3-olate Traditional Name: 6-[[(1R)-1-(4-ethylphenyl)-2-methyl-propyl]carbamoyl]pyridazin-3-olate Formula: C17H20N3O2- MolecularWeight: 298.3596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(C)C)NC(=O)C2=NN=C(C=C2)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H](C(C)C)NC(=O)C2=NN=C(C=C2)[O-]

InChI

InChI=1S/C17H21N3O2/c1-4-12-5-7-13(8-6-12)16(11(2)3)18-17(22)14-9-10-15(21)20-19-14/h5-11,16H,4H2,1-3H3,(H,18,22)(H,20,21)/p-1/t16-/m1/s1