1-[[2,6-bis(fluoranyl)phenyl]methyl]-5-nitro-indole-2-carboxylic acid

Systemtic Name: 1-[[2,6-bis(fluoranyl)phenyl]methyl]-5-nitro-indole-2-carboxylic acid Openeye Name: 1-[(2,6-difluorophenyl)methyl]-5-nitro-indole-2-carboxylic acid CAS Name: 1-[(2,6-difluorophenyl)methyl]-5-nitro-2-indolecarboxylic acid IUPAC Name: 1-[(2,6-difluorophenyl)methyl]-5-nitroindole-2-carboxylic acid Traditional Name: 1-(2,6-difluorobenzyl)-5-nitro-indole-2-carboxylic acid Formula: C16H10F2N2O4 MolecularWeight: 332.258406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)F)CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=C2C(=O)O)F

Isomeric SMILES

C1=CC(=C(C(=C1)F)CN2C3=C(C=C(C=C3)[N+](=O)[O-])C=C2C(=O)O)F

InChI

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