methyl 5-(oxidanylamino)-2-[[4-(4-oxidanylbut-1-ynyl)phenyl]carbonylamino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl 5-(oxidanylamino)-2-[[4-(4-oxidanylbut-1-ynyl)phenyl]carbonylamino]-5-oxidanylidene-pentanoate Openeye Name: methyl 5-(hydroxyamino)-2-[[4-(4-hydroxybut-1-ynyl)benzoyl]amino]-5-oxo-pentanoate CAS Name: 5-(hydroxyamino)-2-[[[4-(4-hydroxybut-1-ynyl)phenyl]-oxomethyl]amino]-5-oxopentanoic acid methyl ester IUPAC Name: methyl 5-(hydroxyamino)-2-[[4-(4-hydroxybut-1-ynyl)benzoyl]amino]-5-oxopentanoate Traditional Name: 5-(hydroxyamino)-2-[[4-(4-hydroxybut-1-ynyl)benzoyl]amino]-5-keto-valeric acid methyl ester Formula: C17H20N2O6 MolecularWeight: 348.3505

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(=O)NO)NC(=O)C1=CC=C(C=C1)C#CCCO

Isomeric SMILES

COC(=O)C(CCC(=O)NO)NC(=O)C1=CC=C(C=C1)C#CCCO

InChI

InChI=1S/C17H20N2O6/c1-25-17(23)14(9-10-15(21)19-24)18-16(22)13-7-5-12(6-8-13)4-2-3-11-20/h5-8,14,20,24H,3,9-11H2,1H3,(H,18,22)(H,19,21)