ethyl 1-[2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[2-[(2-fluorophenyl)carbonylamino]-3-methyl-butanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[2-[(2-fluorobenzoyl)amino]-3-methyl-butanoyl]piperidine-3-carboxylate CAS Name: 1-[2-[[(2-fluorophenyl)-oxomethyl]amino]-3-methyl-1-oxobutyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[(2-fluorobenzoyl)amino]-3-methylbutanoyl]piperidine-3-carboxylate Traditional Name: 1-[2-[(2-fluorobenzoyl)amino]-3-methyl-butanoyl]nipecotic acid ethyl ester Formula: C20H27FN2O4 MolecularWeight: 378.437783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C(C(C)C)NC(=O)C2=CC=CC=C2F

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C(C(C)C)NC(=O)C2=CC=CC=C2F

InChI

InChI=1S/C20H27FN2O4/c1-4-27-20(26)14-8-7-11-23(12-14)19(25)17(13(2)3)22-18(24)15-9-5-6-10-16(15)21/h5-6,9-10,13-14,17H,4,7-8,11-12H2,1-3H3,(H,22,24)