2-(3-azanyl-5-nitro-2-oxidanylidene-3H-indol-1-yl)-N-(cyanomethyl)ethanamide

Systemtic Name: 2-(3-azanyl-5-nitro-2-oxidanylidene-3H-indol-1-yl)-N-(cyanomethyl)ethanamide Openeye Name: 2-(3-amino-5-nitro-2-oxo-indolin-1-yl)-N-(cyanomethyl)acetamide CAS Name: 2-(3-amino-5-nitro-2-oxo-3H-indol-1-yl)-N-(cyanomethyl)acetamide IUPAC Name: 2-(3-amino-5-nitro-2-oxo-3H-indol-1-yl)-N-(cyanomethyl)acetamide Traditional Name: 2-(3-amino-2-keto-5-nitro-indolin-1-yl)-N-(cyanomethyl)acetamide Formula: C12H11N5O4 MolecularWeight: 289.24684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(C(=O)N2CC(=O)NCC#N)N

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(C(=O)N2CC(=O)NCC#N)N

InChI

InChI=1S/C12H11N5O4/c13-3-4-15-10(18)6-16-9-2-1-7(17(20)21)5-8(9)11(14)12(16)19/h1-2,5,11H,4,6,14H2,(H,15,18)