6-chloranyl-3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-1,4-benzoxazin-2-one

Systemtic Name: 6-chloranyl-3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-1,4-benzoxazin-2-one Openeye Name: 6-chloro-3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxo-propyl]-1,4-benzoxazin-2-one CAS Name: 6-chloro-3-[3-[4-(4-fluorophenyl)-1-piperazinyl]-3-oxopropyl]-1,4-benzoxazin-2-one IUPAC Name: 6-chloro-3-[3-[4-(4-fluorophenyl)piperazin-1-yl]-3-oxopropyl]-1,4-benzoxazin-2-one Traditional Name: 6-chloro-3-[3-[4-(4-fluorophenyl)piperazino]-3-keto-propyl]-1,4-benzoxazin-2-one Formula: C21H19ClFN3O3 MolecularWeight: 415.845263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCC3=NC4=C(C=CC(=C4)Cl)OC3=O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CCC3=NC4=C(C=CC(=C4)Cl)OC3=O

InChI

InChI=1S/C21H19ClFN3O3/c22-14-1-7-19-18(13-14)24-17(21(28)29-19)6-8-20(27)26-11-9-25(10-12-26)16-4-2-15(23)3-5-16/h1-5,7,13H,6,8-12H2