ethyl 3-bromanyl-1-[(4-fluorophenyl)methyl]-5-phenylmethoxy-indole-2-carboxylate

Systemtic Name: ethyl 3-bromanyl-1-[(4-fluorophenyl)methyl]-5-phenylmethoxy-indole-2-carboxylate Openeye Name: ethyl 5-benzyloxy-3-bromo-1-[(4-fluorophenyl)methyl]indole-2-carboxylate CAS Name: 3-bromo-1-[(4-fluorophenyl)methyl]-5-phenylmethoxy-2-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-bromo-1-[(4-fluorophenyl)methyl]-5-phenylmethoxyindole-2-carboxylate Traditional Name: 5-benzoxy-3-bromo-1-(4-fluorobenzyl)indole-2-carboxylic acid ethyl ester Formula: C25H21BrFNO3 MolecularWeight: 482.341543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1CC3=CC=C(C=C3)F)C=CC(=C2)OCC4=CC=CC=C4)Br

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1CC3=CC=C(C=C3)F)C=CC(=C2)OCC4=CC=CC=C4)Br

InChI

InChI=1S/C25H21BrFNO3/c1-2-30-25(29)24-23(26)21-14-20(31-16-18-6-4-3-5-7-18)12-13-22(21)28(24)15-17-8-10-19(27)11-9-17/h3-14H,2,15-16H2,1H3