methyl 4-(5-azanyl-3-morpholin-4-yl-1,2,4-triazol-1-yl)-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(5-azanyl-3-morpholin-4-yl-1,2,4-triazol-1-yl)-4-oxidanylidene-butanoate Openeye Name: methyl 4-(5-amino-3-morpholino-1,2,4-triazol-1-yl)-4-oxo-butanoate CAS Name: 4-[5-amino-3-(4-morpholinyl)-1,2,4-triazol-1-yl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(5-amino-3-morpholin-4-yl-1,2,4-triazol-1-yl)-4-oxobutanoate Traditional Name: 4-(5-amino-3-morpholino-1,2,4-triazol-1-yl)-4-keto-butyric acid methyl ester Formula: C11H17N5O4 MolecularWeight: 283.28378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(=O)N1C(=NC(=N1)N2CCOCC2)N

Isomeric SMILES

COC(=O)CCC(=O)N1C(=NC(=N1)N2CCOCC2)N

InChI

InChI=1S/C11H17N5O4/c1-19-9(18)3-2-8(17)16-10(12)13-11(14-16)15-4-6-20-7-5-15/h2-7H2,1H3,(H2,12,13,14)