ethyl 3-[[5-[(2,5-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: ethyl 3-[[5-[(2,5-dimethylphenoxy)methyl]-1,2-oxazol-3-yl]carbonylamino]-4-methyl-pentanoate Openeye Name: ethyl 3-[[5-[(2,5-dimethylphenoxy)methyl]isoxazole-3-carbonyl]amino]-4-methyl-pentanoate CAS Name: 3-[[[5-[(2,5-dimethylphenoxy)methyl]-3-isoxazolyl]-oxomethyl]amino]-4-methylpentanoic acid ethyl ester IUPAC Name: ethyl 3-[[5-[(2,5-dimethylphenoxy)methyl]-1,2-oxazole-3-carbonyl]amino]-4-methylpentanoate Traditional Name: 3-[[5-[(2,5-dimethylphenoxy)methyl]isoxazole-3-carbonyl]amino]-4-methyl-valeric acid ethyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(C)C)NC(=O)C1=NOC(=C1)COC2=C(C=CC(=C2)C)C

Isomeric SMILES

CCOC(=O)CC(C(C)C)NC(=O)C1=NOC(=C1)COC2=C(C=CC(=C2)C)C

InChI

InChI=1S/C21H28N2O5/c1-6-26-20(24)11-17(13(2)3)22-21(25)18-10-16(28-23-18)12-27-19-9-14(4)7-8-15(19)5/h7-10,13,17H,6,11-12H2,1-5H3,(H,22,25)