5-chloranyl-6-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1-oxidanyl-propyl]-3-methyl-1,3-benzoxazol-2-one

Systemtic Name: 5-chloranyl-6-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1-oxidanyl-propyl]-3-methyl-1,3-benzoxazol-2-one Openeye Name: 5-chloro-6-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1-hydroxy-propyl]-3-methyl-1,3-benzoxazol-2-one CAS Name: 5-chloro-6-[2-[4-(4-fluorophenyl)-1-piperazinyl]-1-hydroxypropyl]-3-methyl-1,3-benzoxazol-2-one IUPAC Name: 5-chloro-6-[2-[4-(4-fluorophenyl)piperazin-1-yl]-1-hydroxypropyl]-3-methyl-1,3-benzoxazol-2-one Traditional Name: 5-chloro-6-[2-[4-(4-fluorophenyl)piperazino]-1-hydroxy-propyl]-3-methyl-1,3-benzoxazol-2-one Formula: C21H23ClFN3O3 MolecularWeight: 419.877023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC2=C(C=C1Cl)N(C(=O)O2)C)O)N3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C(C1=CC2=C(C=C1Cl)N(C(=O)O2)C)O)N3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H23ClFN3O3/c1-13(25-7-9-26(10-8-25)15-5-3-14(23)4-6-15)20(27)16-11-19-18(12-17(16)22)24(2)21(28)29-19/h3-6,11-13,20,27H,7-10H2,1-2H3