2,2-bis(2-methylphenoxy)-2-(1-pyridin-3-ylcarbonylpiperidin-4-yl)ethanoic acid

Systemtic Name: 2,2-bis(2-methylphenoxy)-2-(1-pyridin-3-ylcarbonylpiperidin-4-yl)ethanoic acid Openeye Name: 2,2-bis(2-methylphenoxy)-2-[1-(pyridine-3-carbonyl)-4-piperidyl]acetic acid CAS Name: 2,2-bis(2-methylphenoxy)-2-[1-[oxo(3-pyridinyl)methyl]-4-piperidinyl]acetic acid IUPAC Name: 2,2-bis(2-methylphenoxy)-2-[1-(pyridine-3-carbonyl)piperidin-4-yl]acetic acid Traditional Name: 2,2-bis(2-methylphenoxy)-2-(1-nicotinoyl-4-piperidyl)acetic acid Formula: C27H28N2O5 MolecularWeight: 460.52162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28N2O5/c1-19-8-3-5-11-23(19)33-27(26(31)32,34-24-12-6-4-9-20(24)2)22-13-16-29(17-14-22)25(30)21-10-7-15-28-18-21/h3-12,15,18,22H,13-14,16-17H2,1-2H3,(H,31,32)