1-[3-fluoranyl-4-[4-[(3-phenyl-2,1-benzoxazol-5-yl)carbonyl]piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[3-fluoranyl-4-[4-[(3-phenyl-2,1-benzoxazol-5-yl)carbonyl]piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[3-fluoro-4-[4-(3-phenyl-2,1-benzoxazole-5-carbonyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[3-fluoro-4-[4-[oxo-(3-phenyl-2,1-benzoxazol-5-yl)methyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[3-fluoro-4-[4-(3-phenyl-2,1-benzoxazole-5-carbonyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[3-fluoro-4-[4-(3-phenylanthranil-5-carbonyl)piperazino]phenyl]ethanone Formula: C26H22FN3O3 MolecularWeight: 443.469583

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=C(ON=C4C=C3)C5=CC=CC=C5)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)C3=CC4=C(ON=C4C=C3)C5=CC=CC=C5)F

InChI

InChI=1S/C26H22FN3O3/c1-17(31)19-8-10-24(22(27)16-19)29-11-13-30(14-12-29)26(32)20-7-9-23-21(15-20)25(33-28-23)18-5-3-2-4-6-18/h2-10,15-16H,11-14H2,1H3