ethyl 5-[butanoyl-(4-methylphenyl)sulfonyl-amino]-2-phenyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[butanoyl-(4-methylphenyl)sulfonyl-amino]-2-phenyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[butanoyl(p-tolylsulfonyl)amino]-2-phenyl-benzofuran-3-carboxylate CAS Name: 5-[(4-methylphenyl)sulfonyl-(1-oxobutyl)amino]-2-phenyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[butanoyl-(4-methylphenyl)sulfonylamino]-2-phenyl-1-benzofuran-3-carboxylate Traditional Name: 5-[butyryl(tosyl)amino]-2-phenyl-benzofuran-3-carboxylic acid ethyl ester Formula: C28H27NO6S MolecularWeight: 505.58208

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H27NO6S/c1-4-9-25(30)29(36(32,33)22-15-12-19(3)13-16-22)21-14-17-24-23(18-21)26(28(31)34-5-2)27(35-24)20-10-7-6-8-11-20/h6-8,10-18H,4-5,9H2,1-3H3