ethyl (3R)-3-[[5-[(3-methoxyphenoxy)methyl]-1,2-oxazol-3-yl]carbonylamino]heptanoate

Systemtic Name: ethyl (3R)-3-[[5-[(3-methoxyphenoxy)methyl]-1,2-oxazol-3-yl]carbonylamino]heptanoate Openeye Name: ethyl (3R)-3-[[5-[(3-methoxyphenoxy)methyl]isoxazole-3-carbonyl]amino]heptanoate CAS Name: (3R)-3-[[[5-[(3-methoxyphenoxy)methyl]-3-isoxazolyl]-oxomethyl]amino]heptanoic acid ethyl ester IUPAC Name: ethyl (3R)-3-[[5-[(3-methoxyphenoxy)methyl]-1,2-oxazole-3-carbonyl]amino]heptanoate Traditional Name: (3R)-3-[[5-[(3-methoxyphenoxy)methyl]isoxazole-3-carbonyl]amino]enanthic acid ethyl ester Formula: C21H28N2O6 MolecularWeight: 404.45682

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(=O)OCC)NC(=O)C1=NOC(=C1)COC2=CC=CC(=C2)OC

Isomeric SMILES

CCCC[C@H](CC(=O)OCC)NC(=O)C1=NOC(=C1)COC2=CC=CC(=C2)OC

InChI

InChI=1S/C21H28N2O6/c1-4-6-8-15(11-20(24)27-5-2)22-21(25)19-13-18(29-23-19)14-28-17-10-7-9-16(12-17)26-3/h7,9-10,12-13,15H,4-6,8,11,14H2,1-3H3,(H,22,25)/t15-/m1/s1