methyl (2S)-5-azanyl-2-(7-azanyl-3-oxidanylidene-1H-isoindol-2-yl)-5-oxidanylidene-pentanoate

Systemtic Name: methyl (2S)-5-azanyl-2-(7-azanyl-3-oxidanylidene-1H-isoindol-2-yl)-5-oxidanylidene-pentanoate Openeye Name: methyl (2S)-5-amino-2-(4-amino-1-oxo-isoindolin-2-yl)-5-oxo-pentanoate CAS Name: (2S)-5-amino-2-(7-amino-3-oxo-1H-isoindol-2-yl)-5-oxopentanoic acid methyl ester IUPAC Name: methyl (2S)-5-amino-2-(7-amino-3-oxo-1H-isoindol-2-yl)-5-oxopentanoate Traditional Name: (2S)-5-amino-2-(4-amino-1-keto-isoindolin-2-yl)-5-keto-valeric acid methyl ester Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(=O)N)N1CC2=C(C1=O)C=CC=C2N

Isomeric SMILES

COC(=O)[C@H](CCC(=O)N)N1CC2=C(C1=O)C=CC=C2N

InChI

InChI=1S/C14H17N3O4/c1-21-14(20)11(5-6-12(16)18)17-7-9-8(13(17)19)3-2-4-10(9)15/h2-4,11H,5-7,15H2,1H3,(H2,16,18)/t11-/m0/s1