methyl 4-[[5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1,2-oxazol-3-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1,2-oxazol-3-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[5-(2-methyl-2,3-dihydrobenzofuran-5-yl)isoxazole-3-carbonyl]amino]benzoate CAS Name: 4-[[[5-(2-methyl-2,3-dihydrobenzofuran-5-yl)-3-isoxazolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-1,2-oxazole-3-carbonyl]amino]benzoate Traditional Name: 4-[[5-(2-methylcoumaran-5-yl)isoxazole-3-carbonyl]amino]benzoic acid methyl ester Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C=CC(=C2)C3=CC(=NO3)C(=O)NC4=CC=C(C=C4)C(=O)OC

Isomeric SMILES

CC1CC2=C(O1)C=CC(=C2)C3=CC(=NO3)C(=O)NC4=CC=C(C=C4)C(=O)OC

InChI

InChI=1S/C21H18N2O5/c1-12-9-15-10-14(5-8-18(15)27-12)19-11-17(23-28-19)20(24)22-16-6-3-13(4-7-16)21(25)26-2/h3-8,10-12H,9H2,1-2H3,(H,22,24)