2-[1-[(5-methanoyl-2-methoxy-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanoic acid

Systemtic Name: 2-[1-[(5-methanoyl-2-methoxy-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanoic acid Openeye Name: 2-[1-[(5-formyl-2-methoxy-phenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanoic acid CAS Name: 2-[1-[(5-formyl-2-methoxyphenyl)methyl]-3,5-dimethyl-4-pyrazolyl]propanoic acid IUPAC Name: 2-[1-[(5-formyl-2-methoxyphenyl)methyl]-3,5-dimethylpyrazol-4-yl]propanoic acid Traditional Name: 2-[1-(5-formyl-2-methoxy-benzyl)-3,5-dimethyl-pyrazol-4-yl]propionic acid Formula: C17H20N2O4 MolecularWeight: 316.3517

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)C=O)OC)C)C(C)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)C=O)OC)C)C(C)C(=O)O

InChI

InChI=1S/C17H20N2O4/c1-10(17(21)22)16-11(2)18-19(12(16)3)8-14-7-13(9-20)5-6-15(14)23-4/h5-7,9-10H,8H2,1-4H3,(H,21,22)