methyl 5-[butanoyl(quinolin-8-ylsulfonyl)amino]-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: methyl 5-[butanoyl(quinolin-8-ylsulfonyl)amino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[butanoyl(8-quinolylsulfonyl)amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 2-methyl-5-[1-oxobutyl(8-quinolinylsulfonyl)amino]-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[butanoyl(quinolin-8-ylsulfonyl)amino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[butyryl(8-quinolylsulfonyl)amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C24H22N2O6S MolecularWeight: 466.50628

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=CC2=C(C=C1)OC(=C2C(=O)OC)C)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CCCC(=O)N(C1=CC2=C(C=C1)OC(=C2C(=O)OC)C)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C24H22N2O6S/c1-4-7-21(27)26(33(29,30)20-10-5-8-16-9-6-13-25-23(16)20)17-11-12-19-18(14-17)22(15(2)32-19)24(28)31-3/h5-6,8-14H,4,7H2,1-3H3