ethanoic acid; 1-piperidin-1-ylpropyl 2-[3-(phenylcarbonyl)phenyl]propanoate

Systemtic Name: ethanoic acid; 1-piperidin-1-ylpropyl 2-[3-(phenylcarbonyl)phenyl]propanoate Openeye Name: acetic acid; 1-(1-piperidyl)propyl 2-(3-benzoylphenyl)propanoate CAS Name: acetic acid; 2-(3-benzoylphenyl)propanoic acid 1-(1-piperidinyl)propyl ester IUPAC Name: acetic acid; 1-piperidin-1-ylpropyl 2-(3-benzoylphenyl)propanoate Traditional Name: acetic acid; 2-(3-benzoylphenyl)propionic acid 1-piperidinopropyl ester Formula: C26H33NO5 MolecularWeight: 439.54392

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1CCCCC1)OC(=O)C(C)C2=CC=CC(=C2)C(=O)C3=CC=CC=C3.CC(=O)O

Isomeric SMILES

CCC(N1CCCCC1)OC(=O)C(C)C2=CC=CC(=C2)C(=O)C3=CC=CC=C3.CC(=O)O

InChI

InChI=1S/C24H29NO3.C2H4O2/c1-3-22(25-15-8-5-9-16-25)28-24(27)18(2)20-13-10-14-21(17-20)23(26)19-11-6-4-7-12-19;1-2(3)4/h4,6-7,10-14,17-18,22H,3,5,8-9,15-16H2,1-2H3;1H3,(H,3,4)