methyl 4-[[5-(2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1,2-oxazol-3-yl]methylcarbamoyl]benzoate

Systemtic Name: methyl 4-[[5-(2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1,2-oxazol-3-yl]methylcarbamoyl]benzoate Openeye Name: methyl 4-[[5-(2-methyl-2,3-dihydrobenzofuran-6-yl)isoxazol-3-yl]methylcarbamoyl]benzoate CAS Name: 4-[[[5-(2-methyl-2,3-dihydrobenzofuran-6-yl)-3-isoxazolyl]methylamino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[5-(2-methyl-2,3-dihydro-1-benzofuran-6-yl)-1,2-oxazol-3-yl]methylcarbamoyl]benzoate Traditional Name: 4-[[5-(2-methylcoumaran-6-yl)isoxazol-3-yl]methylcarbamoyl]benzoic acid methyl ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2O5/c1-13-9-16-7-8-17(10-19(16)28-13)20-11-18(24-29-20)12-23-21(25)14-3-5-15(6-4-14)22(26)27-2/h3-8,10-11,13H,9,12H2,1-2H3,(H,23,25)