methyl 9-(4-cyanophenyl)-3,5-bis(oxidanyl)nonanoate

Systemtic Name: methyl 9-(4-cyanophenyl)-3,5-bis(oxidanyl)nonanoate Openeye Name: methyl 9-(4-cyanophenyl)-3,5-dihydroxy-nonanoate CAS Name: 9-(4-cyanophenyl)-3,5-dihydroxynonanoic acid methyl ester IUPAC Name: methyl 9-(4-cyanophenyl)-3,5-dihydroxynonanoate Traditional Name: 9-(4-cyanophenyl)-3,5-dihydroxy-pelargonic acid methyl ester Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(CCCCC1=CC=C(C=C1)C#N)O)O

Isomeric SMILES

COC(=O)CC(CC(CCCCC1=CC=C(C=C1)C#N)O)O

InChI

InChI=1S/C17H23NO4/c1-22-17(21)11-16(20)10-15(19)5-3-2-4-13-6-8-14(12-18)9-7-13/h6-9,15-16,19-20H,2-5,10-11H2,1H3