2-[[1-(4-azanylbutanoyl)-5,7-dinitro-2,3-dihydroindol-4-yl]oxy]ethanoic acid

Systemtic Name: 2-[[1-(4-azanylbutanoyl)-5,7-dinitro-2,3-dihydroindol-4-yl]oxy]ethanoic acid Openeye Name: 2-[1-(4-aminobutanoyl)-5,7-dinitro-indolin-4-yl]oxyacetic acid CAS Name: 2-[[1-(4-amino-1-oxobutyl)-5,7-dinitro-2,3-dihydroindol-4-yl]oxy]acetic acid IUPAC Name: 2-[[1-(4-aminobutanoyl)-5,7-dinitro-2,3-dihydroindol-4-yl]oxy]acetic acid Traditional Name: 2-[1-(4-aminobutanoyl)-5,7-dinitro-indolin-4-yl]oxyacetic acid Formula: C14H16N4O8 MolecularWeight: 368.29884

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])OCC(=O)O)C(=O)CCCN

Isomeric SMILES

C1CN(C2=C1C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])OCC(=O)O)C(=O)CCCN

InChI

InChI=1S/C14H16N4O8/c15-4-1-2-11(19)16-5-3-8-13(16)9(17(22)23)6-10(18(24)25)14(8)26-7-12(20)21/h6H,1-5,7,15H2,(H,20,21)