3-[3,5-dimethyl-1-(6-pyrrolidin-1-ylpyridazin-3-yl)pyrazol-4-yl]propanoic acid

Systemtic Name: 3-[3,5-dimethyl-1-(6-pyrrolidin-1-ylpyridazin-3-yl)pyrazol-4-yl]propanoic acid Openeye Name: 3-[3,5-dimethyl-1-(6-pyrrolidin-1-ylpyridazin-3-yl)pyrazol-4-yl]propanoic acid CAS Name: 3-[3,5-dimethyl-1-[6-(1-pyrrolidinyl)-3-pyridazinyl]-4-pyrazolyl]propanoic acid IUPAC Name: 3-[3,5-dimethyl-1-(6-pyrrolidin-1-ylpyridazin-3-yl)pyrazol-4-yl]propanoic acid Traditional Name: 3-[3,5-dimethyl-1-(6-pyrrolidinopyridazin-3-yl)pyrazol-4-yl]propionic acid Formula: C16H21N5O2 MolecularWeight: 315.37024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=NN=C(C=C2)N3CCCC3)C)CCC(=O)O

Isomeric SMILES

CC1=C(C(=NN1C2=NN=C(C=C2)N3CCCC3)C)CCC(=O)O

InChI

InChI=1S/C16H21N5O2/c1-11-13(5-8-16(22)23)12(2)21(19-11)15-7-6-14(17-18-15)20-9-3-4-10-20/h6-7H,3-5,8-10H2,1-2H3,(H,22,23)