[5-azanyl-2-(2-chloroethylsulfonyl)phenyl]methanesulfonic acid

Systemtic Name: [5-azanyl-2-(2-chloroethylsulfonyl)phenyl]methanesulfonic acid Openeye Name: [5-amino-2-(2-chloroethylsulfonyl)phenyl]methanesulfonic acid CAS Name: [5-amino-2-(2-chloroethylsulfonyl)phenyl]methanesulfonic acid IUPAC Name: [5-amino-2-(2-chloroethylsulfonyl)phenyl]methanesulfonic acid Traditional Name: [5-amino-2-(2-chloroethylsulfonyl)phenyl]methanesulfonic acid Formula: C9H12ClNO5S2 MolecularWeight: 313.77828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)CS(=O)(=O)O)S(=O)(=O)CCCl

Isomeric SMILES

C1=CC(=C(C=C1N)CS(=O)(=O)O)S(=O)(=O)CCCl

InChI

InChI=1S/C9H12ClNO5S2/c10-3-4-17(12,13)9-2-1-8(11)5-7(9)6-18(14,15)16/h1-2,5H,3-4,6,11H2,(H,14,15,16)