ethyl 5-[(oxan-4-ylmethylamino)methyl]-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-[(oxan-4-ylmethylamino)methyl]-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-[(tetrahydropyran-4-ylmethylamino)methyl]isoxazole-3-carboxylate CAS Name: 5-[(4-oxanylmethylamino)methyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(oxan-4-ylmethylamino)methyl]-1,2-oxazole-3-carboxylate Traditional Name: 5-[(tetrahydropyran-4-ylmethylamino)methyl]isoxazole-3-carboxylic acid ethyl ester Formula: C13H20N2O4 MolecularWeight: 268.3089

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1)CNCC2CCOCC2

Isomeric SMILES

CCOC(=O)C1=NOC(=C1)CNCC2CCOCC2

InChI

InChI=1S/C13H20N2O4/c1-2-18-13(16)12-7-11(19-15-12)9-14-8-10-3-5-17-6-4-10/h7,10,14H,2-6,8-9H2,1H3