4-[2,6-bis(chloranyl)-3-methyl-phenyl]azanidylsulfonylbutanoate

Systemtic Name: 4-[2,6-bis(chloranyl)-3-methyl-phenyl]azanidylsulfonylbutanoate Openeye Name: 4-(2,6-dichloro-3-methyl-phenyl)azanidylsulfonylbutanoate CAS Name: 4-(2,6-dichloro-3-methylphenyl)azanidylsulfonylbutanoate IUPAC Name: 4-(2,6-dichloro-3-methylphenyl)azanidylsulfonylbutanoate Traditional Name: 4-(2,6-dichloro-3-methyl-phenyl)azanidylsulfonylbutyrate Formula: C11H11Cl2NO4S-2 MolecularWeight: 324.18034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Cl)[N-]S(=O)(=O)CCCC(=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)Cl)[N-]S(=O)(=O)CCCC(=O)[O-])Cl

InChI

InChI=1S/C11H12Cl2NO4S/c1-7-4-5-8(12)11(10(7)13)14-19(17,18)6-2-3-9(15)16/h4-5H,2-3,6H2,1H3,(H,15,16)/q-1/p-1