methyl 3-[[[(2R)-2,3-dihydro-1-benzofuran-2-yl]carbonylamino]methyl]-5-(2-phenylethanoylamino)benzoate

Systemtic Name: methyl 3-[[[(2R)-2,3-dihydro-1-benzofuran-2-yl]carbonylamino]methyl]-5-(2-phenylethanoylamino)benzoate Openeye Name: methyl 3-[[[(2R)-2,3-dihydrobenzofuran-2-carbonyl]amino]methyl]-5-[(2-phenylacetyl)amino]benzoate CAS Name: 3-[[[[(2R)-2,3-dihydrobenzofuran-2-yl]-oxomethyl]amino]methyl]-5-[(1-oxo-2-phenylethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[[(2R)-2,3-dihydro-1-benzofuran-2-carbonyl]amino]methyl]-5-[(2-phenylacetyl)amino]benzoate Traditional Name: 3-[[[(2R)-coumaran-2-carbonyl]amino]methyl]-5-[(2-phenylacetyl)amino]benzoic acid methyl ester Formula: C26H24N2O5 MolecularWeight: 444.47916

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CC2=CC=CC=C2)CNC(=O)C3CC4=CC=CC=C4O3

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CC2=CC=CC=C2)CNC(=O)[C@H]3CC4=CC=CC=C4O3

InChI

InChI=1S/C26H24N2O5/c1-32-26(31)20-11-18(12-21(14-20)28-24(29)13-17-7-3-2-4-8-17)16-27-25(30)23-15-19-9-5-6-10-22(19)33-23/h2-12,14,23H,13,15-16H2,1H3,(H,27,30)(H,28,29)/t23-/m1/s1