1-[[2,4-bis(fluoranyl)phenyl]methyl]-5-nitro-indole-2-carboxylic acid

Systemtic Name: 1-[[2,4-bis(fluoranyl)phenyl]methyl]-5-nitro-indole-2-carboxylic acid Openeye Name: 1-[(2,4-difluorophenyl)methyl]-5-nitro-indole-2-carboxylic acid CAS Name: 1-[(2,4-difluorophenyl)methyl]-5-nitro-2-indolecarboxylic acid IUPAC Name: 1-[(2,4-difluorophenyl)methyl]-5-nitroindole-2-carboxylic acid Traditional Name: 1-(2,4-difluorobenzyl)-5-nitro-indole-2-carboxylic acid Formula: C16H10F2N2O4 MolecularWeight: 332.258406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])C=C(N2CC3=C(C=C(C=C3)F)F)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])C=C(N2CC3=C(C=C(C=C3)F)F)C(=O)O

InChI

InChI=1S/C16H10F2N2O4/c17-11-2-1-9(13(18)7-11)8-19-14-4-3-12(20(23)24)5-10(14)6-15(19)16(21)22/h1-7H,8H2,(H,21,22)