[(E)-1-[4-(2-fluorophenyl)phenyl]propylideneamino] 2-(1-adamantyl)ethanoate

Systemtic Name: [(E)-1-[4-(2-fluorophenyl)phenyl]propylideneamino] 2-(1-adamantyl)ethanoate Openeye Name: [(E)-1-[4-(2-fluorophenyl)phenyl]propylideneamino] 2-(1-adamantyl)acetate CAS Name: 2-(1-adamantyl)acetic acid [(E)-1-[4-(2-fluorophenyl)phenyl]propylideneamino] ester IUPAC Name: [(E)-1-[4-(2-fluorophenyl)phenyl]propylideneamino] 2-(1-adamantyl)acetate Traditional Name: 2-(1-adamantyl)acetic acid [(E)-1-[4-(2-fluorophenyl)phenyl]propylideneamino] ester Formula: C27H30FNO2 MolecularWeight: 419.531003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=NOC(=O)CC12CC3CC(C1)CC(C3)C2)C4=CC=C(C=C4)C5=CC=CC=C5F

Isomeric SMILES

CC/C(=N\OC(=O)CC12CC3CC(C1)CC(C3)C2)/C4=CC=C(C=C4)C5=CC=CC=C5F

InChI

InChI=1S/C27H30FNO2/c1-2-25(22-9-7-21(8-10-22)23-5-3-4-6-24(23)28)29-31-26(30)17-27-14-18-11-19(15-27)13-20(12-18)16-27/h3-10,18-20H,2,11-17H2,1H3/b29-25+