methyl 2-methyl-5-[(3-nitrophenyl)carbonyl-(2,4,6-trimethylphenyl)sulfonyl-amino]-1-benzofuran-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[(3-nitrophenyl)carbonyl-(2,4,6-trimethylphenyl)sulfonyl-amino]-1-benzofuran-3-carboxylate Openeye Name: methyl 2-methyl-5-[(3-nitrobenzoyl)-(2,4,6-trimethylphenyl)sulfonyl-amino]benzofuran-3-carboxylate CAS Name: 2-methyl-5-[[(3-nitrophenyl)-oxomethyl]-(2,4,6-trimethylphenyl)sulfonylamino]-3-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 2-methyl-5-[(3-nitrobenzoyl)-(2,4,6-trimethylphenyl)sulfonylamino]-1-benzofuran-3-carboxylate Traditional Name: 5-[mesitylsulfonyl-(3-nitrobenzoyl)amino]-2-methyl-benzofuran-3-carboxylic acid methyl ester Formula: C27H24N2O8S MolecularWeight: 536.55306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OC)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OC)C)C(=O)C4=CC(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C27H24N2O8S/c1-15-11-16(2)25(17(3)12-15)38(34,35)28(26(30)19-7-6-8-21(13-19)29(32)33)20-9-10-23-22(14-20)24(18(4)37-23)27(31)36-5/h6-14H,1-5H3