6-(hydroxymethyl)-7-(4-methoxycarbonylphenyl)heptanoic acid

Systemtic Name: 6-(hydroxymethyl)-7-(4-methoxycarbonylphenyl)heptanoic acid Openeye Name: 6-(hydroxymethyl)-7-(4-methoxycarbonylphenyl)heptanoic acid CAS Name: 6-(hydroxymethyl)-7-(4-methoxycarbonylphenyl)heptanoic acid IUPAC Name: 6-(hydroxymethyl)-7-(4-methoxycarbonylphenyl)heptanoic acid Traditional Name: 6-(4-carbomethoxybenzyl)-7-hydroxy-enanthic acid Formula: C16H22O5 MolecularWeight: 294.34288

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CC(CCCCC(=O)O)CO

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CC(CCCCC(=O)O)CO

InChI

InChI=1S/C16H22O5/c1-21-16(20)14-8-6-12(7-9-14)10-13(11-17)4-2-3-5-15(18)19/h6-9,13,17H,2-5,10-11H2,1H3,(H,18,19)