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

Systemtic Name: 2-[butanoyl(furan-2-ylmethyl)amino]-4-chloranyl-5-sulfamoyl-benzoic acid Openeye Name: 2-[butanoyl(2-furylmethyl)amino]-4-chloro-5-sulfamoyl-benzoic acid CAS Name: 4-chloro-2-[2-furanylmethyl(1-oxobutyl)amino]-5-sulfamoylbenzoic acid IUPAC Name: 2-[butanoyl(furan-2-ylmethyl)amino]-4-chloro-5-sulfamoylbenzoic acid Traditional Name: 2-[butyryl(2-furfuryl)amino]-4-chloro-5-sulfamoyl-benzoic acid Formula: C16H17ClN2O6S MolecularWeight: 400.83398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17ClN2O6S/c1-2-4-15(20)19(9-10-5-3-6-25-10)13-8-12(17)14(26(18,23)24)7-11(13)16(21)22/h3,5-8H,2,4,9H2,1H3,(H,21,22)(H2,18,23,24)