5-chloranyl-3-[4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,3-benzoxazol-2-one

Systemtic Name: 5-chloranyl-3-[4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxidanylidene-butyl]-1,3-benzoxazol-2-one Openeye Name: 5-chloro-3-[4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxo-butyl]-1,3-benzoxazol-2-one CAS Name: 5-chloro-3-[4-[4-(4-fluorophenyl)-1-piperazinyl]-4-oxobutyl]-1,3-benzoxazol-2-one IUPAC Name: 5-chloro-3-[4-[4-(4-fluorophenyl)piperazin-1-yl]-4-oxobutyl]-1,3-benzoxazol-2-one Traditional Name: 5-chloro-3-[4-[4-(4-fluorophenyl)piperazino]-4-keto-butyl]-1,3-benzoxazol-2-one Formula: C21H21ClFN3O3 MolecularWeight: 417.861143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCCN3C4=C(C=CC(=C4)Cl)OC3=O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCCN3C4=C(C=CC(=C4)Cl)OC3=O

InChI

InChI=1S/C21H21ClFN3O3/c22-15-3-8-19-18(14-15)26(21(28)29-19)9-1-2-20(27)25-12-10-24(11-13-25)17-6-4-16(23)5-7-17/h3-8,14H,1-2,9-13H2