6-[3-[3-tert-butyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-(2-hydroxyethyloxy)phenyl]pyridine-3-carboxylic acid

Systemtic Name: 6-[3-[3-tert-butyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-4-(2-hydroxyethyloxy)phenyl]pyridine-3-carboxylic acid Openeye Name: 6-[3-[3-tert-butyl-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxylic acid CAS Name: 6-[3-[3-tert-butyl-4-(2-oxo-1-pyrrolidinyl)phenyl]-4-(2-hydroxyethoxy)phenyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[3-[3-tert-butyl-4-(2-oxopyrrolidin-1-yl)phenyl]-4-(2-hydroxyethoxy)phenyl]pyridine-3-carboxylic acid Traditional Name: 6-[3-[3-tert-butyl-4-(2-ketopyrrolidino)phenyl]-4-(2-hydroxyethoxy)phenyl]nicotinic acid Formula: C28H30N2O5 MolecularWeight: 474.5482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C2=C(C=CC(=C2)C3=NC=C(C=C3)C(=O)O)OCCO)N4CCCC4=O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C2=C(C=CC(=C2)C3=NC=C(C=C3)C(=O)O)OCCO)N4CCCC4=O

InChI

InChI=1S/C28H30N2O5/c1-28(2,3)22-16-18(7-10-24(22)30-12-4-5-26(30)32)21-15-19(8-11-25(21)35-14-13-31)23-9-6-20(17-29-23)27(33)34/h6-11,15-17,31H,4-5,12-14H2,1-3H3,(H,33,34)