2-[[4-butyl-3-methoxy-2-(methoxymethoxy)phenyl]methyl]-4,5-dimethoxy-6-methoxycarbonyl-pyridine-3-carboxylic acid

Systemtic Name: 2-[[4-butyl-3-methoxy-2-(methoxymethoxy)phenyl]methyl]-4,5-dimethoxy-6-methoxycarbonyl-pyridine-3-carboxylic acid Openeye Name: 2-[[4-butyl-3-methoxy-2-(methoxymethoxy)phenyl]methyl]-4,5-dimethoxy-6-methoxycarbonyl-pyridine-3-carboxylic acid CAS Name: 2-[[4-butyl-3-methoxy-2-(methoxymethoxy)phenyl]methyl]-4,5-dimethoxy-6-methoxycarbonyl-3-pyridinecarboxylic acid IUPAC Name: 2-[[4-butyl-3-methoxy-2-(methoxymethoxy)phenyl]methyl]-4,5-dimethoxy-6-methoxycarbonylpyridine-3-carboxylic acid Traditional Name: 2-[4-butyl-3-methoxy-2-(methoxymethoxy)benzyl]-6-carbomethoxy-4,5-dimethoxy-nicotinic acid Formula: C24H31NO9 MolecularWeight: 477.50424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C(C=C1)CC2=NC(=C(C(=C2C(=O)O)OC)OC)C(=O)OC)OCOC)OC

Isomeric SMILES

CCCCC1=C(C(=C(C=C1)CC2=NC(=C(C(=C2C(=O)O)OC)OC)C(=O)OC)OCOC)OC

InChI

InChI=1S/C24H31NO9/c1-7-8-9-14-10-11-15(20(19(14)30-3)34-13-29-2)12-16-17(23(26)27)21(31-4)22(32-5)18(25-16)24(28)33-6/h10-11H,7-9,12-13H2,1-6H3,(H,26,27)