methyl 3-(2-azanylethylsulfonylamino)-4-chloranyl-benzoate

Systemtic Name: methyl 3-(2-azanylethylsulfonylamino)-4-chloranyl-benzoate Openeye Name: methyl 3-(2-aminoethylsulfonylamino)-4-chloro-benzoate CAS Name: 3-(2-aminoethylsulfonylamino)-4-chlorobenzoic acid methyl ester IUPAC Name: methyl 3-(2-aminoethylsulfonylamino)-4-chlorobenzoate Traditional Name: 4-chloro-3-(taurylamino)benzoic acid methyl ester Formula: C10H13ClN2O4S MolecularWeight: 292.73922

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NS(=O)(=O)CCN

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NS(=O)(=O)CCN

InChI

InChI=1S/C10H13ClN2O4S/c1-17-10(14)7-2-3-8(11)9(6-7)13-18(15,16)5-4-12/h2-3,6,13H,4-5,12H2,1H3