3-[5-nitro-2,3-bis(oxidanylidene)indol-1-yl]propanoic acid

Systemtic Name: 3-[5-nitro-2,3-bis(oxidanylidene)indol-1-yl]propanoic acid Openeye Name: 3-(5-nitro-2,3-dioxo-indolin-1-yl)propanoic acid CAS Name: 3-(5-nitro-2,3-dioxo-1-indolyl)propanoic acid IUPAC Name: 3-(5-nitro-2,3-dioxoindol-1-yl)propanoic acid Traditional Name: 3-(2,3-diketo-5-nitro-indolin-1-yl)propionic acid Formula: C11H8N2O6 MolecularWeight: 264.19102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2CCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C(=O)C(=O)N2CCC(=O)O

InChI

InChI=1S/C11H8N2O6/c14-9(15)3-4-12-8-2-1-6(13(18)19)5-7(8)10(16)11(12)17/h1-2,5H,3-4H2,(H,14,15)