9-(4-cyanophenyl)-3,5-bis(oxidanyl)nonanoic acid

Systemtic Name: 9-(4-cyanophenyl)-3,5-bis(oxidanyl)nonanoic acid Openeye Name: 9-(4-cyanophenyl)-3,5-dihydroxy-nonanoic acid CAS Name: 9-(4-cyanophenyl)-3,5-dihydroxynonanoic acid IUPAC Name: 9-(4-cyanophenyl)-3,5-dihydroxynonanoic acid Traditional Name: 9-(4-cyanophenyl)-3,5-dihydroxy-pelargonic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCCC(CC(CC(=O)O)O)O)C#N

Isomeric SMILES

C1=CC(=CC=C1CCCCC(CC(CC(=O)O)O)O)C#N

InChI

InChI=1S/C16H21NO4/c17-11-13-7-5-12(6-8-13)3-1-2-4-14(18)9-15(19)10-16(20)21/h5-8,14-15,18-19H,1-4,9-10H2,(H,20,21)