ethyl 4-(cyclopropylmethyl)-1-[3-(3-fluorophenyl)phenyl]carbonyl-piperidine-4-carboxylate

Systemtic Name: ethyl 4-(cyclopropylmethyl)-1-[3-(3-fluorophenyl)phenyl]carbonyl-piperidine-4-carboxylate Openeye Name: ethyl 4-(cyclopropylmethyl)-1-[3-(3-fluorophenyl)benzoyl]piperidine-4-carboxylate CAS Name: 4-(cyclopropylmethyl)-1-[[3-(3-fluorophenyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(cyclopropylmethyl)-1-[3-(3-fluorophenyl)benzoyl]piperidine-4-carboxylate Traditional Name: 4-(cyclopropylmethyl)-1-[3-(3-fluorophenyl)benzoyl]isonipecotic acid ethyl ester Formula: C25H28FNO3 MolecularWeight: 409.493123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)C2=CC=CC(=C2)C3=CC(=CC=C3)F)CC4CC4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)C2=CC=CC(=C2)C3=CC(=CC=C3)F)CC4CC4

InChI

InChI=1S/C25H28FNO3/c1-2-30-24(29)25(17-18-9-10-18)11-13-27(14-12-25)23(28)21-7-3-5-19(15-21)20-6-4-8-22(26)16-20/h3-8,15-16,18H,2,9-14,17H2,1H3