(2S)-3-methyl-2-[[8-(5-methyl-3-phenyl-1,2-oxazol-4-yl)dibenzofuran-3-yl]sulfonylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[[8-(5-methyl-3-phenyl-1,2-oxazol-4-yl)dibenzofuran-3-yl]sulfonylamino]butanoic acid Openeye Name: (2S)-3-methyl-2-[[8-(5-methyl-3-phenyl-isoxazol-4-yl)dibenzofuran-3-yl]sulfonylamino]butanoic acid CAS Name: (2S)-3-methyl-2-[[8-(5-methyl-3-phenyl-4-isoxazolyl)-3-dibenzofuranyl]sulfonylamino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[[8-(5-methyl-3-phenyl-1,2-oxazol-4-yl)dibenzofuran-3-yl]sulfonylamino]butanoic acid Traditional Name: (2S)-3-methyl-2-[[8-(5-methyl-3-phenyl-isoxazol-4-yl)dibenzofuran-3-yl]sulfonylamino]butyric acid Formula: C27H24N2O6S MolecularWeight: 504.55426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC4=C(C=C3)OC5=C4C=CC(=C5)S(=O)(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C3=CC4=C(C=C3)OC5=C4C=CC(=C5)S(=O)(=O)N[C@@H](C(C)C)C(=O)O

InChI

InChI=1S/C27H24N2O6S/c1-15(2)25(27(30)31)29-36(32,33)19-10-11-20-21-13-18(9-12-22(21)34-23(20)14-19)24-16(3)35-28-26(24)17-7-5-4-6-8-17/h4-15,25,29H,1-3H3,(H,30,31)/t25-/m0/s1