methyl 2-(2-chlorophenyl)-2-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]ethanoate

Systemtic Name: methyl 2-(2-chlorophenyl)-2-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]ethanoate Openeye Name: methyl 2-(2-chlorophenyl)-2-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]acetate CAS Name: 2-(2-chlorophenyl)-2-[4-(2,3-dimethyl-5-nitrophenyl)sulfonyl-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-(2-chlorophenyl)-2-[4-(2,3-dimethyl-5-nitrophenyl)sulfonylpiperazin-1-yl]acetate Traditional Name: 2-(2-chlorophenyl)-2-[4-(2,3-dimethyl-5-nitro-phenyl)sulfonylpiperazino]acetic acid methyl ester Formula: C21H24ClN3O6S MolecularWeight: 481.94976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2)C(C3=CC=CC=C3Cl)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1C)S(=O)(=O)N2CCN(CC2)C(C3=CC=CC=C3Cl)C(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H24ClN3O6S/c1-14-12-16(25(27)28)13-19(15(14)2)32(29,30)24-10-8-23(9-11-24)20(21(26)31-3)17-6-4-5-7-18(17)22/h4-7,12-13,20H,8-11H2,1-3H3