[3-[(5-bromanylfuran-2-yl)carbonylamino]phenyl] 4-methyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: [3-[(5-bromanylfuran-2-yl)carbonylamino]phenyl] 4-methyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: [3-[(5-bromofuran-2-carbonyl)amino]phenyl] 4-methyl-3-morpholinosulfonyl-benzoate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)benzoic acid [3-[[(5-bromo-2-furanyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [3-[(5-bromofuran-2-carbonyl)amino]phenyl] 4-methyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methyl-3-morpholinosulfonyl-benzoic acid [3-[(5-bromo-2-furoyl)amino]phenyl] ester Formula: C23H21BrN2O7S MolecularWeight: 549.39104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)NC(=O)C3=CC=C(O3)Br)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC2=CC=CC(=C2)NC(=O)C3=CC=C(O3)Br)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C23H21BrN2O7S/c1-15-5-6-16(13-20(15)34(29,30)26-9-11-31-12-10-26)23(28)32-18-4-2-3-17(14-18)25-22(27)19-7-8-21(24)33-19/h2-8,13-14H,9-12H2,1H3,(H,25,27)