2-azanyl-4-[2-(2-chloroethylsulfonyl)ethylcarbamoyl]benzenesulfonic acid

Systemtic Name: 2-azanyl-4-[2-(2-chloroethylsulfonyl)ethylcarbamoyl]benzenesulfonic acid Openeye Name: 2-amino-4-[2-(2-chloroethylsulfonyl)ethylcarbamoyl]benzenesulfonic acid CAS Name: 2-amino-4-[[2-(2-chloroethylsulfonyl)ethylamino]-oxomethyl]benzenesulfonic acid IUPAC Name: 2-amino-4-[2-(2-chloroethylsulfonyl)ethylcarbamoyl]benzenesulfonic acid Traditional Name: 2-amino-4-[2-(2-chloroethylsulfonyl)ethylcarbamoyl]besylic acid Formula: C11H15ClN2O6S2 MolecularWeight: 370.8296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)NCCS(=O)(=O)CCCl)N)S(=O)(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=O)NCCS(=O)(=O)CCCl)N)S(=O)(=O)O

InChI

InChI=1S/C11H15ClN2O6S2/c12-3-5-21(16,17)6-4-14-11(15)8-1-2-10(9(13)7-8)22(18,19)20/h1-2,7H,3-6,13H2,(H,14,15)(H,18,19,20)