6-[[2-(4-fluorophenyl)-6-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-1H-indole-2-carboxylic acid

Systemtic Name: 6-[[2-(4-fluorophenyl)-6-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-1H-indole-2-carboxylic acid Openeye Name: 6-[[2-(4-fluorophenyl)-6-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-1H-indole-2-carboxylic acid CAS Name: 6-[[2-(4-fluorophenyl)-6-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-1H-indole-2-carboxylic acid IUPAC Name: 6-[[2-(4-fluorophenyl)-6-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-1H-indole-2-carboxylic acid Traditional Name: 6-[[2-(4-fluorophenyl)-6-methyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]-1H-indole-2-carboxylic acid Formula: C26H23FN2O2 MolecularWeight: 414.471423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(N(CC2)C3=CC=C(C=C3)F)CC4=CC5=C(C=C4)C=C(N5)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)C(N(CC2)C3=CC=C(C=C3)F)CC4=CC5=C(C=C4)C=C(N5)C(=O)O

InChI

InChI=1S/C26H23FN2O2/c1-16-2-9-22-18(12-16)10-11-29(21-7-5-20(27)6-8-21)25(22)14-17-3-4-19-15-24(26(30)31)28-23(19)13-17/h2-9,12-13,15,25,28H,10-11,14H2,1H3,(H,30,31)