4-[[(2S)-2-acetamido-3-(4-fluorophenyl)propanoyl]amino]-N-(2-ethylphenyl)piperidine-1-carboxamide

Systemtic Name: 4-[[(2S)-2-acetamido-3-(4-fluorophenyl)propanoyl]amino]-N-(2-ethylphenyl)piperidine-1-carboxamide Openeye Name: 4-[[(2S)-2-acetamido-3-(4-fluorophenyl)propanoyl]amino]-N-(2-ethylphenyl)piperidine-1-carboxamide CAS Name: 4-[[(2S)-2-acetamido-3-(4-fluorophenyl)-1-oxopropyl]amino]-N-(2-ethylphenyl)-1-piperidinecarboxamide IUPAC Name: 4-[[(2S)-2-acetamido-3-(4-fluorophenyl)propanoyl]amino]-N-(2-ethylphenyl)piperidine-1-carboxamide Traditional Name: 4-[[(2S)-2-acetamido-3-(4-fluorophenyl)propanoyl]amino]-N-(2-ethylphenyl)piperidine-1-carboxamide Formula: C25H31FN4O3 MolecularWeight: 454.537043

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)N2CCC(CC2)NC(=O)C(CC3=CC=C(C=C3)F)NC(=O)C

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)N2CCC(CC2)NC(=O)[C@H](CC3=CC=C(C=C3)F)NC(=O)C

InChI

InChI=1S/C25H31FN4O3/c1-3-19-6-4-5-7-22(19)29-25(33)30-14-12-21(13-15-30)28-24(32)23(27-17(2)31)16-18-8-10-20(26)11-9-18/h4-11,21,23H,3,12-16H2,1-2H3,(H,27,31)(H,28,32)(H,29,33)/t23-/m0/s1