6-chloranyl-7-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-chloranyl-7-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-chloro-7-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one CAS Name: 6-chloro-7-[[4-[(2-fluorophenyl)methyl]-1-piperazinyl]sulfonyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-chloro-7-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]sulfonyl-4H-1,4-benzoxazin-3-one Traditional Name: 6-chloro-7-[4-(2-fluorobenzyl)piperazino]sulfonyl-4H-1,4-benzoxazin-3-one Formula: C19H19ClFN3O4S MolecularWeight: 439.888263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2F)S(=O)(=O)C3=C(C=C4C(=C3)OCC(=O)N4)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2F)S(=O)(=O)C3=C(C=C4C(=C3)OCC(=O)N4)Cl

InChI

InChI=1S/C19H19ClFN3O4S/c20-14-9-16-17(28-12-19(25)22-16)10-18(14)29(26,27)24-7-5-23(6-8-24)11-13-3-1-2-4-15(13)21/h1-4,9-10H,5-8,11-12H2,(H,22,25)