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

Systemtic Name: methyl 5-[butanoyl(naphthalen-2-ylsulfonyl)amino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[butanoyl(2-naphthylsulfonyl)amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 2-methyl-5-[2-naphthalenylsulfonyl(1-oxobutyl)amino]-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[butanoyl(naphthalen-2-ylsulfonyl)amino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[butyryl(2-naphthylsulfonyl)amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C25H23NO6S MolecularWeight: 465.51822

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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=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCC(=O)N(C1=CC2=C(C=C1)OC(=C2C(=O)OC)C)S(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C25H23NO6S/c1-4-7-23(27)26(33(29,30)20-12-10-17-8-5-6-9-18(17)14-20)19-11-13-22-21(15-19)24(16(2)32-22)25(28)31-3/h5-6,8-15H,4,7H2,1-3H3