4-(3-fluorophenyl)sulfonyl-8-piperazin-1-yl-spiro[3H-1,4-benzoxazine-2,1'-cyclobutane]

Systemtic Name: 4-(3-fluorophenyl)sulfonyl-8-piperazin-1-yl-spiro[3H-1,4-benzoxazine-2,1'-cyclobutane] Openeye Name: 4-(3-fluorophenyl)sulfonyl-8-piperazin-1-yl-spiro[3H-1,4-benzoxazine-2,1'-cyclobutane] CAS Name: 4-(3-fluorophenyl)sulfonyl-8-(1-piperazinyl)spiro[3H-1,4-benzoxazine-2,1'-cyclobutane] IUPAC Name: 4-(3-fluorophenyl)sulfonyl-8-piperazin-1-ylspiro[3H-1,4-benzoxazine-2,1'-cyclobutane] Traditional Name: 4-(3-fluorophenyl)sulfonyl-8-piperazino-spiro[3H-1,4-benzoxazine-2,1'-cyclobutane] Formula: C21H24FN3O3S MolecularWeight: 417.496963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2(C1)CN(C3=CC=CC(=C3O2)N4CCNCC4)S(=O)(=O)C5=CC=CC(=C5)F

Isomeric SMILES

C1CC2(C1)CN(C3=CC=CC(=C3O2)N4CCNCC4)S(=O)(=O)C5=CC=CC(=C5)F

InChI

InChI=1S/C21H24FN3O3S/c22-16-4-1-5-17(14-16)29(26,27)25-15-21(8-3-9-21)28-20-18(6-2-7-19(20)25)24-12-10-23-11-13-24/h1-2,4-7,14,23H,3,8-13,15H2