6-chloranyl-3-[[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-chloranyl-3-[[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Openeye Name: 6-chloro-3-[[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one CAS Name: 6-chloro-3-[[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methyl]-1,3-benzoxazol-2-one IUPAC Name: 6-chloro-3-[[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methyl]-1,3-benzoxazol-2-one Traditional Name: 6-chloro-3-[[4-(3-fluoro-4-methoxy-benzyl)piperazino]methyl]-1,3-benzoxazol-2-one Formula: C20H21ClFN3O3 MolecularWeight: 405.850443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)CN3C4=C(C=C(C=C4)Cl)OC3=O)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)CN3C4=C(C=C(C=C4)Cl)OC3=O)F

InChI

InChI=1S/C20H21ClFN3O3/c1-27-18-5-2-14(10-16(18)22)12-23-6-8-24(9-7-23)13-25-17-4-3-15(21)11-19(17)28-20(25)26/h2-5,10-11H,6-9,12-13H2,1H3