1-[1-(4-chloranyl-3-nitro-phenyl)sulfonylpiperidin-4-yl]-6-methyl-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-[1-(4-chloranyl-3-nitro-phenyl)sulfonylpiperidin-4-yl]-6-methyl-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-(4-chloro-3-nitro-phenyl)sulfonyl-4-piperidyl]-6-methyl-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-(4-chloro-3-nitrophenyl)sulfonyl-4-piperidinyl]-6-methyl-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-(4-chloro-3-nitrophenyl)sulfonylpiperidin-4-yl]-6-methyl-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-(4-chloro-3-nitro-phenyl)sulfonyl-4-piperidyl]-6-methyl-4H-3,1-benzoxazin-2-one Formula: C20H20ClN3O6S MolecularWeight: 465.9073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)OC2)C3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)OC2)C3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H20ClN3O6S/c1-13-2-5-18-14(10-13)12-30-20(25)23(18)15-6-8-22(9-7-15)31(28,29)16-3-4-17(21)19(11-16)24(26)27/h2-5,10-11,15H,6-9,12H2,1H3