6-(6-nitro-1H-indol-3-yl)-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-(6-nitro-1H-indol-3-yl)-6-oxidanylidene-hexanoic acid Openeye Name: 6-(6-nitro-1H-indol-3-yl)-6-oxo-hexanoic acid CAS Name: 6-(6-nitro-1H-indol-3-yl)-6-oxohexanoic acid IUPAC Name: 6-(6-nitro-1H-indol-3-yl)-6-oxohexanoic acid Traditional Name: 6-keto-6-(6-nitro-1H-indol-3-yl)hexanoic acid Formula: C14H14N2O5 MolecularWeight: 290.27136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])NC=C2C(=O)CCCCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC=C2C(=O)CCCCC(=O)O

InChI

InChI=1S/C14H14N2O5/c17-13(3-1-2-4-14(18)19)11-8-15-12-7-9(16(20)21)5-6-10(11)12/h5-8,15H,1-4H2,(H,18,19)