3-[4-(1H-indol-5-ylmethyl)-3,5-dimethyl-pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-(1H-indol-5-ylmethyl)-3,5-dimethyl-pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-(1H-indol-5-ylmethyl)-3,5-dimethyl-pyrazol-1-yl]propanoic acid CAS Name: 3-[4-(1H-indol-5-ylmethyl)-3,5-dimethyl-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-(1H-indol-5-ylmethyl)-3,5-dimethylpyrazol-1-yl]propanoic acid Traditional Name: 3-[4-(1H-indol-5-ylmethyl)-3,5-dimethyl-pyrazol-1-yl]propionic acid Formula: C17H19N3O2 MolecularWeight: 297.35166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)O)C)CC2=CC3=C(C=C2)NC=C3

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)O)C)CC2=CC3=C(C=C2)NC=C3

InChI

InChI=1S/C17H19N3O2/c1-11-15(12(2)20(19-11)8-6-17(21)22)10-13-3-4-16-14(9-13)5-7-18-16/h3-5,7,9,18H,6,8,10H2,1-2H3,(H,21,22)