2-[(2-butoxy-5-chloranyl-4-methyl-phenyl)sulfonylamino]benzoic acid

Systemtic Name: 2-[(2-butoxy-5-chloranyl-4-methyl-phenyl)sulfonylamino]benzoic acid Openeye Name: 2-[(2-butoxy-5-chloro-4-methyl-phenyl)sulfonylamino]benzoic acid CAS Name: 2-[(2-butoxy-5-chloro-4-methylphenyl)sulfonylamino]benzoic acid IUPAC Name: 2-[(2-butoxy-5-chloro-4-methylphenyl)sulfonylamino]benzoic acid Traditional Name: 2-[(2-butoxy-5-chloro-4-methyl-phenyl)sulfonylamino]benzoic acid Formula: C18H20ClNO5S MolecularWeight: 397.8731

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C(=C1)C)Cl)S(=O)(=O)NC2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCOC1=C(C=C(C(=C1)C)Cl)S(=O)(=O)NC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H20ClNO5S/c1-3-4-9-25-16-10-12(2)14(19)11-17(16)26(23,24)20-15-8-6-5-7-13(15)18(21)22/h5-8,10-11,20H,3-4,9H2,1-2H3,(H,21,22)