2-azanyl-5-[2-chloroethylsulfonyl(ethyl)carbamoyl]benzenesulfonic acid

Systemtic Name: 2-azanyl-5-[2-chloroethylsulfonyl(ethyl)carbamoyl]benzenesulfonic acid Openeye Name: 2-amino-5-[2-chloroethylsulfonyl(ethyl)carbamoyl]benzenesulfonic acid CAS Name: 2-amino-5-[[2-chloroethylsulfonyl(ethyl)amino]-oxomethyl]benzenesulfonic acid IUPAC Name: 2-amino-5-[2-chloroethylsulfonyl(ethyl)carbamoyl]benzenesulfonic acid Traditional Name: 2-amino-5-[2-chloroethylsulfonyl(ethyl)carbamoyl]besylic acid Formula: C11H15ClN2O6S2 MolecularWeight: 370.8296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)C1=CC(=C(C=C1)N)S(=O)(=O)O)S(=O)(=O)CCCl

Isomeric SMILES

CCN(C(=O)C1=CC(=C(C=C1)N)S(=O)(=O)O)S(=O)(=O)CCCl

InChI

InChI=1S/C11H15ClN2O6S2/c1-2-14(21(16,17)6-5-12)11(15)8-3-4-9(13)10(7-8)22(18,19)20/h3-4,7H,2,5-6,13H2,1H3,(H,18,19,20)