6-chloranyl-7-(4-methylpiperazin-1-yl)sulfonyl-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-chloranyl-7-(4-methylpiperazin-1-yl)sulfonyl-4H-1,4-benzoxazin-3-one Openeye Name: 6-chloro-7-(4-methylpiperazin-1-yl)sulfonyl-4H-1,4-benzoxazin-3-one CAS Name: 6-chloro-7-[(4-methyl-1-piperazinyl)sulfonyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-chloro-7-(4-methylpiperazin-1-yl)sulfonyl-4H-1,4-benzoxazin-3-one Traditional Name: 6-chloro-7-(4-methylpiperazino)sulfonyl-4H-1,4-benzoxazin-3-one Formula: C13H16ClN3O4S MolecularWeight: 345.80184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=C(C=C3C(=C2)OCC(=O)N3)Cl

InChI

InChI=1S/C13H16ClN3O4S/c1-16-2-4-17(5-3-16)22(19,20)12-7-11-10(6-9(12)14)15-13(18)8-21-11/h6-7H,2-5,8H2,1H3,(H,15,18)