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

Systemtic Name: methyl 5-[cyclohexylcarbonyl(naphthalen-2-ylsulfonyl)amino]-2-methyl-1-benzofuran-3-carboxylate Openeye Name: methyl 5-[cyclohexanecarbonyl(2-naphthylsulfonyl)amino]-2-methyl-benzofuran-3-carboxylate CAS Name: 5-[[cyclohexyl(oxo)methyl]-(2-naphthalenylsulfonyl)amino]-2-methyl-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 5-[cyclohexanecarbonyl(naphthalen-2-ylsulfonyl)amino]-2-methyl-1-benzofuran-3-carboxylate Traditional Name: 5-[cyclohexanecarbonyl(2-naphthylsulfonyl)amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C28H27NO6S MolecularWeight: 505.58208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C=CC(=C2)N(C(=O)C3CCCCC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(=O)OC

Isomeric SMILES

CC1=C(C2=C(O1)C=CC(=C2)N(C(=O)C3CCCCC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(=O)OC

InChI

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