[3-bromanyl-1-[[3-(trifluoromethyl)phenyl]methyl]indol-2-yl] hydrogen carbonate

Systemtic Name: [3-bromanyl-1-[[3-(trifluoromethyl)phenyl]methyl]indol-2-yl] hydrogen carbonate Openeye Name: [3-bromo-1-[[3-(trifluoromethyl)phenyl]methyl]indol-2-yl] hydrogen carbonate CAS Name: carbonic acid [3-bromo-1-[[3-(trifluoromethyl)phenyl]methyl]-2-indolyl] ester IUPAC Name: [3-bromo-1-[[3-(trifluoromethyl)phenyl]methyl]indol-2-yl] hydrogen carbonate Traditional Name: carbonic acid [3-bromo-1-[3-(trifluoromethyl)benzyl]indol-2-yl] ester Formula: C17H11BrF3NO3 MolecularWeight: 414.17335

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(N2CC3=CC(=CC=C3)C(F)(F)F)OC(=O)O)Br

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(N2CC3=CC(=CC=C3)C(F)(F)F)OC(=O)O)Br

InChI

InChI=1S/C17H11BrF3NO3/c18-14-12-6-1-2-7-13(12)22(15(14)25-16(23)24)9-10-4-3-5-11(8-10)17(19,20)21/h1-8H,9H2,(H,23,24)