2-methylpropanoic acid; 1,1,5-triphenyl-2-piperidin-1-yl-pentane-1,5-diol

Systemtic Name: 2-methylpropanoic acid; 1,1,5-triphenyl-2-piperidin-1-yl-pentane-1,5-diol Openeye Name: 2-methylpropanoic acid; 1,1,5-triphenyl-2-(1-piperidyl)pentane-1,5-diol CAS Name: 2-methylpropanoic acid; 1,1,5-triphenyl-2-(1-piperidinyl)pentane-1,5-diol IUPAC Name: 2-methylpropanoic acid; 1,1,5-triphenyl-2-piperidin-1-ylpentane-1,5-diol Traditional Name: isobutyric acid; 1,1,5-triphenyl-2-piperidino-pentane-1,5-diol Formula: C32H41NO4 MolecularWeight: 503.67224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)O.C1CCN(CC1)C(CCC(C2=CC=CC=C2)O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

Isomeric SMILES

CC(C)C(=O)O.C1CCN(CC1)C(CCC(C2=CC=CC=C2)O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O

InChI

InChI=1S/C28H33NO2.C4H8O2/c30-26(23-13-5-1-6-14-23)19-20-27(29-21-11-4-12-22-29)28(31,24-15-7-2-8-16-24)25-17-9-3-10-18-25;1-3(2)4(5)6/h1-3,5-10,13-18,26-27,30-31H,4,11-12,19-22H2;3H,1-2H3,(H,5,6)