9-[4-(pyridin-3-ylmethyl)phenyl]nonanoic acid

Systemtic Name: 9-[4-(pyridin-3-ylmethyl)phenyl]nonanoic acid Openeye Name: 9-[4-(3-pyridylmethyl)phenyl]nonanoic acid CAS Name: 9-[4-(3-pyridinylmethyl)phenyl]nonanoic acid IUPAC Name: 9-[4-(pyridin-3-ylmethyl)phenyl]nonanoic acid Traditional Name: 9-[4-(3-pyridylmethyl)phenyl]pelargonic acid Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CC2=CC=C(C=C2)CCCCCCCCC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CC2=CC=C(C=C2)CCCCCCCCC(=O)O

InChI

InChI=1S/C21H27NO2/c23-21(24)10-6-4-2-1-3-5-8-18-11-13-19(14-12-18)16-20-9-7-15-22-17-20/h7,9,11-15,17H,1-6,8,10,16H2,(H,23,24)