ethyl 5-[cyclohexylcarbonyl-(4-ethoxyphenyl)sulfonyl-amino]-2-methyl-1-benzofuran-3-carboxylate

Systemtic Name: ethyl 5-[cyclohexylcarbonyl-(4-ethoxyphenyl)sulfonyl-amino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: ethyl 5-[cyclohexanecarbonyl-(4-ethoxyphenyl)sulfonyl-amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[[cyclohexyl(oxo)methyl]-(4-ethoxyphenyl)sulfonylamino]-2-methyl-3-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[cyclohexanecarbonyl-(4-ethoxyphenyl)sulfonylamino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[cyclohexanecarbonyl(p-phenetylsulfonyl)amino]-2-methyl-benzofuran-3-carboxylic acid ethyl ester Formula: C27H31NO7S MolecularWeight: 513.60254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OCC)C)C(=O)C4CCCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OCC)C)C(=O)C4CCCCC4

InChI

InChI=1S/C27H31NO7S/c1-4-33-21-12-14-22(15-13-21)36(31,32)28(26(29)19-9-7-6-8-10-19)20-11-16-24-23(17-20)25(18(3)35-24)27(30)34-5-2/h11-17,19H,4-10H2,1-3H3