3-[[5-(2-azanyl-2-oxidanylidene-ethoxy)-2-chloranyl-4-methyl-phenyl]sulfonylamino]benzoate

Systemtic Name: 3-[[5-(2-azanyl-2-oxidanylidene-ethoxy)-2-chloranyl-4-methyl-phenyl]sulfonylamino]benzoate Openeye Name: 3-[[5-(2-amino-2-oxo-ethoxy)-2-chloro-4-methyl-phenyl]sulfonylamino]benzoate CAS Name: 3-[[5-(2-amino-2-oxoethoxy)-2-chloro-4-methylphenyl]sulfonylamino]benzoate IUPAC Name: 3-[[5-(2-amino-2-oxoethoxy)-2-chloro-4-methylphenyl]sulfonylamino]benzoate Traditional Name: 3-[[5-(2-amino-2-keto-ethoxy)-2-chloro-4-methyl-phenyl]sulfonylamino]benzoate Formula: C16H14ClN2O6S- MolecularWeight: 397.81016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OCC(=O)N)S(=O)(=O)NC2=CC=CC(=C2)C(=O)[O-])Cl

Isomeric SMILES

CC1=CC(=C(C=C1OCC(=O)N)S(=O)(=O)NC2=CC=CC(=C2)C(=O)[O-])Cl

InChI

InChI=1S/C16H15ClN2O6S/c1-9-5-12(17)14(7-13(9)25-8-15(18)20)26(23,24)19-11-4-2-3-10(6-11)16(21)22/h2-7,19H,8H2,1H3,(H2,18,20)(H,21,22)/p-1