3-[5-(diethylamino)-3-methyl-1-phenyl-pyrazol-4-yl]propanoate

Systemtic Name: 3-[5-(diethylamino)-3-methyl-1-phenyl-pyrazol-4-yl]propanoate Openeye Name: 3-[5-(diethylamino)-3-methyl-1-phenyl-pyrazol-4-yl]propanoate CAS Name: 3-[5-(diethylamino)-3-methyl-1-phenyl-4-pyrazolyl]propanoate IUPAC Name: 3-[5-(diethylamino)-3-methyl-1-phenylpyrazol-4-yl]propanoate Traditional Name: 3-[5-(diethylamino)-3-methyl-1-phenyl-pyrazol-4-yl]propionate Formula: C17H22N3O2- MolecularWeight: 300.37548

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)[O-]

Isomeric SMILES

CCN(CC)C1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)[O-]

InChI

InChI=1S/C17H23N3O2/c1-4-19(5-2)17-15(11-12-16(21)22)13(3)18-20(17)14-9-7-6-8-10-14/h6-10H,4-5,11-12H2,1-3H3,(H,21,22)/p-1