(2R)-2-[3-(3,4-dimethylphenyl)-6-oxidanylidene-pyridazin-1-yl]propanoate

Systemtic Name: (2R)-2-[3-(3,4-dimethylphenyl)-6-oxidanylidene-pyridazin-1-yl]propanoate Openeye Name: (2R)-2-[3-(3,4-dimethylphenyl)-6-oxo-pyridazin-1-yl]propanoate CAS Name: (2R)-2-[3-(3,4-dimethylphenyl)-6-oxo-1-pyridazinyl]propanoate IUPAC Name: (2R)-2-[3-(3,4-dimethylphenyl)-6-oxopyridazin-1-yl]propanoate Traditional Name: (2R)-2-[3-(3,4-dimethylphenyl)-6-keto-pyridazin-1-yl]propionate Formula: C15H15N2O3- MolecularWeight: 271.2912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C(=O)C=C2)[C@H](C)C(=O)[O-])C

InChI

InChI=1S/C15H16N2O3/c1-9-4-5-12(8-10(9)2)13-6-7-14(18)17(16-13)11(3)15(19)20/h4-8,11H,1-3H3,(H,19,20)/p-1/t11-/m1/s1