4-chloranyl-2-[2-ethylbutanoyl(furan-2-ylmethyl)amino]-5-sulfamoyl-benzoic acid

Systemtic Name: 4-chloranyl-2-[2-ethylbutanoyl(furan-2-ylmethyl)amino]-5-sulfamoyl-benzoic acid Openeye Name: 4-chloro-2-[2-ethylbutanoyl(2-furylmethyl)amino]-5-sulfamoyl-benzoic acid CAS Name: 4-chloro-2-[(2-ethyl-1-oxobutyl)-(2-furanylmethyl)amino]-5-sulfamoylbenzoic acid IUPAC Name: 4-chloro-2-[2-ethylbutanoyl(furan-2-ylmethyl)amino]-5-sulfamoylbenzoic acid Traditional Name: 4-chloro-2-[2-ethylbutanoyl(2-furfuryl)amino]-5-sulfamoyl-benzoic acid Formula: C18H21ClN2O6S MolecularWeight: 428.88714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)N(CC1=CC=CO1)C2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl

Isomeric SMILES

CCC(CC)C(=O)N(CC1=CC=CO1)C2=CC(=C(C=C2C(=O)O)S(=O)(=O)N)Cl

InChI

InChI=1S/C18H21ClN2O6S/c1-3-11(4-2)17(22)21(10-12-6-5-7-27-12)15-9-14(19)16(28(20,25)26)8-13(15)18(23)24/h5-9,11H,3-4,10H2,1-2H3,(H,23,24)(H2,20,25,26)