3-butylsulfonylazanidyl-4-chloranyl-benzoate

Systemtic Name: 3-butylsulfonylazanidyl-4-chloranyl-benzoate Openeye Name: 3-butylsulfonylazanidyl-4-chloro-benzoate CAS Name: 3-butylsulfonylazanidyl-4-chlorobenzoate IUPAC Name: 3-butylsulfonylazanidyl-4-chlorobenzoate Traditional Name: 3-butylsulfonylazanidyl-4-chloro-benzoate Formula: C11H12ClNO4S-2 MolecularWeight: 289.73528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)[N-]C1=C(C=CC(=C1)C(=O)[O-])Cl

Isomeric SMILES

CCCCS(=O)(=O)[N-]C1=C(C=CC(=C1)C(=O)[O-])Cl

InChI

InChI=1S/C11H13ClNO4S/c1-2-3-6-18(16,17)13-10-7-8(11(14)15)4-5-9(10)12/h4-5,7H,2-3,6H2,1H3,(H,14,15)/q-1/p-1