3-[4-(5-fluoranyl-1,2-benzoxazol-3-yl)piperazin-1-yl]-2,2-dimethyl-propanoic acid

Systemtic Name: 3-[4-(5-fluoranyl-1,2-benzoxazol-3-yl)piperazin-1-yl]-2,2-dimethyl-propanoic acid Openeye Name: 3-[4-(5-fluoro-1,2-benzoxazol-3-yl)piperazin-1-yl]-2,2-dimethyl-propanoic acid CAS Name: 3-[4-(5-fluoro-1,2-benzoxazol-3-yl)-1-piperazinyl]-2,2-dimethylpropanoic acid IUPAC Name: 3-[4-(5-fluoro-1,2-benzoxazol-3-yl)piperazin-1-yl]-2,2-dimethylpropanoic acid Traditional Name: 3-[4-(5-fluoroindoxazen-3-yl)piperazino]-2,2-dimethyl-propionic acid Formula: C16H20FN3O3 MolecularWeight: 321.346703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CN1CCN(CC1)C2=NOC3=C2C=C(C=C3)F)C(=O)O

Isomeric SMILES

CC(C)(CN1CCN(CC1)C2=NOC3=C2C=C(C=C3)F)C(=O)O

InChI

InChI=1S/C16H20FN3O3/c1-16(2,15(21)22)10-19-5-7-20(8-6-19)14-12-9-11(17)3-4-13(12)23-18-14/h3-4,9H,5-8,10H2,1-2H3,(H,21,22)