5-(3,4-dimethoxyphenoxy)carbonyl-2,6-dimethyl-1-(4-phenylbutyl)-2H-pyridine-3-carboxylic acid

Systemtic Name: 5-(3,4-dimethoxyphenoxy)carbonyl-2,6-dimethyl-1-(4-phenylbutyl)-2H-pyridine-3-carboxylic acid Openeye Name: 5-(3,4-dimethoxyphenoxy)carbonyl-2,6-dimethyl-1-(4-phenylbutyl)-2H-pyridine-3-carboxylic acid CAS Name: 5-[(3,4-dimethoxyphenoxy)-oxomethyl]-2,6-dimethyl-1-(4-phenylbutyl)-2H-pyridine-3-carboxylic acid IUPAC Name: 5-(3,4-dimethoxyphenoxy)carbonyl-2,6-dimethyl-1-(4-phenylbutyl)-2H-pyridine-3-carboxylic acid Traditional Name: 5-(3,4-dimethoxyphenoxy)carbonyl-2,6-dimethyl-1-(4-phenylbutyl)-2H-pyridine-3-carboxylic acid Formula: C27H31NO6 MolecularWeight: 465.53814

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=CC(=C(N1CCCCC2=CC=CC=C2)C)C(=O)OC3=CC(=C(C=C3)OC)OC)C(=O)O

Isomeric SMILES

CC1C(=CC(=C(N1CCCCC2=CC=CC=C2)C)C(=O)OC3=CC(=C(C=C3)OC)OC)C(=O)O

InChI

InChI=1S/C27H31NO6/c1-18-22(26(29)30)17-23(27(31)34-21-13-14-24(32-3)25(16-21)33-4)19(2)28(18)15-9-8-12-20-10-6-5-7-11-20/h5-7,10-11,13-14,16-18H,8-9,12,15H2,1-4H3,(H,29,30)