1-adamantyl (4R)-4-(2-fluorophenyl)-2-methyl-5-oxidanylidene-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate

Systemtic Name: 1-adamantyl (4R)-4-(2-fluorophenyl)-2-methyl-5-oxidanylidene-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Openeye Name: 1-adamantyl (4R)-4-(2-fluorophenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate CAS Name: (4R)-4-(2-fluorophenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid 1-adamantyl ester IUPAC Name: 1-adamantyl (4R)-4-(2-fluorophenyl)-2-methyl-5-oxo-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylate Traditional Name: (4R)-4-(2-fluorophenyl)-5-keto-2-methyl-1,4-dihydroindeno[1,2-b]pyridine-3-carboxylic acid 1-adamantyl ester Formula: C30H28FNO3 MolecularWeight: 469.546623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)C3=CC=CC=C3C2=O)C4=CC=CC=C4F)C(=O)OC56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=C([C@@H](C2=C(N1)C3=CC=CC=C3C2=O)C4=CC=CC=C4F)C(=O)OC56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C30H28FNO3/c1-16-24(29(34)35-30-13-17-10-18(14-30)12-19(11-17)15-30)25(22-8-4-5-9-23(22)31)26-27(32-16)20-6-2-3-7-21(20)28(26)33/h2-9,17-19,25,32H,10-15H2,1H3/t17?,18?,19?,25-,30?/m0/s1