5-azanyl-2-[(7-nitro-3-oxidanylidene-1H-isoindol-2-yl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-azanyl-2-[(7-nitro-3-oxidanylidene-1H-isoindol-2-yl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-amino-2-[(4-nitro-1-oxo-isoindolin-2-yl)amino]-5-oxo-pentanoic acid CAS Name: 5-amino-2-[(7-nitro-3-oxo-1H-isoindol-2-yl)amino]-5-oxopentanoic acid IUPAC Name: 5-amino-2-[(7-nitro-3-oxo-1H-isoindol-2-yl)amino]-5-oxopentanoic acid Traditional Name: 5-amino-5-keto-2-[(1-keto-4-nitro-isoindolin-2-yl)amino]valeric acid Formula: C13H14N4O6 MolecularWeight: 322.27346

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC=C2[N+](=O)[O-])C(=O)N1NC(CCC(=O)N)C(=O)O

Isomeric SMILES

C1C2=C(C=CC=C2[N+](=O)[O-])C(=O)N1NC(CCC(=O)N)C(=O)O

InChI

InChI=1S/C13H14N4O6/c14-11(18)5-4-9(13(20)21)15-16-6-8-7(12(16)19)2-1-3-10(8)17(22)23/h1-3,9,15H,4-6H2,(H2,14,18)(H,20,21)