methyl 2-fluoranyl-6-[3-fluoranyl-4-[(4-indol-1-ylbutanoylamino)methyl]phenyl]benzoate

Systemtic Name: methyl 2-fluoranyl-6-[3-fluoranyl-4-[(4-indol-1-ylbutanoylamino)methyl]phenyl]benzoate Openeye Name: methyl 2-fluoro-6-[3-fluoro-4-[(4-indol-1-ylbutanoylamino)methyl]phenyl]benzoate CAS Name: 2-fluoro-6-[3-fluoro-4-[[[4-(1-indolyl)-1-oxobutyl]amino]methyl]phenyl]benzoic acid methyl ester IUPAC Name: methyl 2-fluoro-6-[3-fluoro-4-[(4-indol-1-ylbutanoylamino)methyl]phenyl]benzoate Traditional Name: 2-fluoro-6-[3-fluoro-4-[(4-indol-1-ylbutanoylamino)methyl]phenyl]benzoic acid methyl ester Formula: C27H24F2N2O3 MolecularWeight: 462.487866

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1F)C2=CC(=C(C=C2)CNC(=O)CCCN3C=CC4=CC=CC=C43)F

Isomeric SMILES

COC(=O)C1=C(C=CC=C1F)C2=CC(=C(C=C2)CNC(=O)CCCN3C=CC4=CC=CC=C43)F

InChI

InChI=1S/C27H24F2N2O3/c1-34-27(33)26-21(7-4-8-22(26)28)19-11-12-20(23(29)16-19)17-30-25(32)10-5-14-31-15-13-18-6-2-3-9-24(18)31/h2-4,6-9,11-13,15-16H,5,10,14,17H2,1H3,(H,30,32)