2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-2,6-bis(phenylmethoxy)phenyl]carbonylpyridine-3-carboxylic acid

Systemtic Name: 2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-2,6-bis(phenylmethoxy)phenyl]carbonylpyridine-3-carboxylic acid Openeye Name: 2-(2,6-dibenzyloxy-4-tert-butoxycarbonyl-benzoyl)pyridine-3-carboxylic acid CAS Name: 2-[[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-2,6-bis(phenylmethoxy)phenyl]-oxomethyl]-3-pyridinecarboxylic acid IUPAC Name: 2-[4-[(2-methylpropan-2-yl)oxycarbonyl]-2,6-bis(phenylmethoxy)benzoyl]pyridine-3-carboxylic acid Traditional Name: 2-(2,6-dibenzoxy-4-tert-butoxycarbonyl-benzoyl)nicotinic acid Formula: C32H29NO7 MolecularWeight: 539.57516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=CC=N3)C(=O)O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=CC=N3)C(=O)O)OCC4=CC=CC=C4

InChI

InChI=1S/C32H29NO7/c1-32(2,3)40-31(37)23-17-25(38-19-21-11-6-4-7-12-21)27(26(18-23)39-20-22-13-8-5-9-14-22)29(34)28-24(30(35)36)15-10-16-33-28/h4-18H,19-20H2,1-3H3,(H,35,36)