(2S)-2-[[4-[4-(benzo[g][1]benzofuran-2-ylcarbonylamino)phenyl]phenyl]sulfonylamino]-3-methyl-butanoic acid

Systemtic Name: (2S)-2-[[4-[4-(benzo[g][1]benzofuran-2-ylcarbonylamino)phenyl]phenyl]sulfonylamino]-3-methyl-butanoic acid Openeye Name: (2S)-2-[[4-[4-(benzo[g]benzofuran-2-carbonylamino)phenyl]phenyl]sulfonylamino]-3-methyl-butanoic acid CAS Name: (2S)-2-[[4-[4-[[2-benzo[g]benzofuranyl(oxo)methyl]amino]phenyl]phenyl]sulfonylamino]-3-methylbutanoic acid IUPAC Name: (2S)-2-[[4-[4-(benzo[g][1]benzofuran-2-carbonylamino)phenyl]phenyl]sulfonylamino]-3-methylbutanoic acid Traditional Name: (2S)-2-[[4-[4-(benzo[g]benzofuran-2-carbonylamino)phenyl]phenyl]sulfonylamino]-3-methyl-butyric acid Formula: C30H26N2O6S MolecularWeight: 542.60224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(O3)C5=CC=CC=C5C=C4

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NS(=O)(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(O3)C5=CC=CC=C5C=C4

InChI

InChI=1S/C30H26N2O6S/c1-18(2)27(30(34)35)32-39(36,37)24-15-11-20(12-16-24)19-9-13-23(14-10-19)31-29(33)26-17-22-8-7-21-5-3-4-6-25(21)28(22)38-26/h3-18,27,32H,1-2H3,(H,31,33)(H,34,35)/t27-/m0/s1