(2S)-3-methyl-2-[[8-[(4-methylphenoxy)carbonylamino]dibenzofuran-3-yl]sulfonylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[[8-[(4-methylphenoxy)carbonylamino]dibenzofuran-3-yl]sulfonylamino]butanoic acid Openeye Name: (2S)-3-methyl-2-[[8-[(4-methylphenoxy)carbonylamino]dibenzofuran-3-yl]sulfonylamino]butanoic acid CAS Name: (2S)-3-methyl-2-[[8-[[(4-methylphenoxy)-oxomethyl]amino]-3-dibenzofuranyl]sulfonylamino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[[8-[(4-methylphenoxy)carbonylamino]dibenzofuran-3-yl]sulfonylamino]butanoic acid Traditional Name: (2S)-3-methyl-2-[[8-[(4-methylphenoxy)carbonylamino]dibenzofuran-3-yl]sulfonylamino]butyric acid Formula: C25H24N2O7S MolecularWeight: 496.53226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC(=O)NC2=CC3=C(C=C2)OC4=C3C=CC(=C4)S(=O)(=O)NC(C(C)C)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)OC(=O)NC2=CC3=C(C=C2)OC4=C3C=CC(=C4)S(=O)(=O)N[C@@H](C(C)C)C(=O)O

InChI

InChI=1S/C25H24N2O7S/c1-14(2)23(24(28)29)27-35(31,32)18-9-10-19-20-12-16(6-11-21(20)34-22(19)13-18)26-25(30)33-17-7-4-15(3)5-8-17/h4-14,23,27H,1-3H3,(H,26,30)(H,28,29)/t23-/m0/s1