2,2-bis(2-methylphenoxy)-2-[1-(phenylcarbonyl)piperidin-4-yl]ethanoic acid

Systemtic Name: 2,2-bis(2-methylphenoxy)-2-[1-(phenylcarbonyl)piperidin-4-yl]ethanoic acid Openeye Name: 2-(1-benzoyl-4-piperidyl)-2,2-bis(2-methylphenoxy)acetic acid CAS Name: 2-(1-benzoyl-4-piperidinyl)-2,2-bis(2-methylphenoxy)acetic acid IUPAC Name: 2-(1-benzoylpiperidin-4-yl)-2,2-bis(2-methylphenoxy)acetic acid Traditional Name: 2-(1-benzoyl-4-piperidyl)-2,2-bis(2-methylphenoxy)acetic acid Formula: C28H29NO5 MolecularWeight: 459.53356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(C2CCN(CC2)C(=O)C3=CC=CC=C3)(C(=O)O)OC4=CC=CC=C4C

Isomeric SMILES

CC1=CC=CC=C1OC(C2CCN(CC2)C(=O)C3=CC=CC=C3)(C(=O)O)OC4=CC=CC=C4C

InChI

InChI=1S/C28H29NO5/c1-20-10-6-8-14-24(20)33-28(27(31)32,34-25-15-9-7-11-21(25)2)23-16-18-29(19-17-23)26(30)22-12-4-3-5-13-22/h3-15,23H,16-19H2,1-2H3,(H,31,32)