5-(5-methanoyl-2,3-dimethoxy-phenoxy)hept-6-ynoic acid

Systemtic Name: 5-(5-methanoyl-2,3-dimethoxy-phenoxy)hept-6-ynoic acid Openeye Name: 5-(5-formyl-2,3-dimethoxy-phenoxy)hept-6-ynoic acid CAS Name: 5-(5-formyl-2,3-dimethoxyphenoxy)-6-heptynoic acid IUPAC Name: 5-(5-formyl-2,3-dimethoxyphenoxy)hept-6-ynoic acid Traditional Name: 5-(5-formyl-2,3-dimethoxy-phenoxy)hept-6-ynoic acid Formula: C16H18O6 MolecularWeight: 306.31052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=O)OC(CCCC(=O)O)C#C)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C=O)OC(CCCC(=O)O)C#C)OC

InChI

InChI=1S/C16H18O6/c1-4-12(6-5-7-15(18)19)22-14-9-11(10-17)8-13(20-2)16(14)21-3/h1,8-10,12H,5-7H2,2-3H3,(H,18,19)