2-[3-(2-azidoethyl)-6-fluoranyl-1H-indol-2-yl]-2-methyl-propanedioic acid

Systemtic Name: 2-[3-(2-azidoethyl)-6-fluoranyl-1H-indol-2-yl]-2-methyl-propanedioic acid Openeye Name: 2-[3-(2-azidoethyl)-6-fluoro-1H-indol-2-yl]-2-methyl-propanedioic acid CAS Name: 2-[3-(2-azidoethyl)-6-fluoro-1H-indol-2-yl]-2-methylpropanedioic acid IUPAC Name: 2-[3-(2-azidoethyl)-6-fluoro-1H-indol-2-yl]-2-methylpropanedioic acid Traditional Name: 2-[3-(2-azidoethyl)-6-fluoro-1H-indol-2-yl]-2-methyl-malonic acid Formula: C14H13FN4O4 MolecularWeight: 320.275823

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C2=C(N1)C=C(C=C2)F)CCN=[N+]=[N-])(C(=O)O)C(=O)O

Isomeric SMILES

CC(C1=C(C2=C(N1)C=C(C=C2)F)CCN=[N+]=[N-])(C(=O)O)C(=O)O

InChI

InChI=1S/C14H13FN4O4/c1-14(12(20)21,13(22)23)11-9(4-5-17-19-16)8-3-2-7(15)6-10(8)18-11/h2-3,6,18H,4-5H2,1H3,(H,20,21)(H,22,23)