methyl 1-(5-fluoranylpentyl)-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate

Systemtic Name: methyl 1-(5-fluoranylpentyl)-4-[phenyl(propanoyl)amino]piperidine-4-carboxylate Openeye Name: methyl 1-(5-fluoropentyl)-4-(N-propanoylanilino)piperidine-4-carboxylate CAS Name: 1-(5-fluoropentyl)-4-[N-(1-oxopropyl)anilino]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(5-fluoropentyl)-4-(N-propanoylanilino)piperidine-4-carboxylate Traditional Name: 1-(5-fluoropentyl)-4-(N-propionylanilino)isonipecotic acid methyl ester Formula: C21H31FN2O3 MolecularWeight: 378.480843

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCCCCF)C(=O)OC

Isomeric SMILES

CCC(=O)N(C1=CC=CC=C1)C2(CCN(CC2)CCCCCF)C(=O)OC

InChI

InChI=1S/C21H31FN2O3/c1-3-19(25)24(18-10-6-4-7-11-18)21(20(26)27-2)12-16-23(17-13-21)15-9-5-8-14-22/h4,6-7,10-11H,3,5,8-9,12-17H2,1-2H3