5-(cyclohexylmethyl)pyridine-3-carboxylic acid

Systemtic Name: 5-(cyclohexylmethyl)pyridine-3-carboxylic acid Openeye Name: 5-(cyclohexylmethyl)pyridine-3-carboxylic acid CAS Name: 5-(cyclohexylmethyl)-3-pyridinecarboxylic acid IUPAC Name: 5-(cyclohexylmethyl)pyridine-3-carboxylic acid Traditional Name: 5-(cyclohexylmethyl)nicotinic acid Formula: C13H17NO2 MolecularWeight: 219.27958

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC2=CN=CC(=C2)C(=O)O

Isomeric SMILES

C1CCC(CC1)CC2=CN=CC(=C2)C(=O)O

InChI

InChI=1S/C13H17NO2/c15-13(16)12-7-11(8-14-9-12)6-10-4-2-1-3-5-10/h7-10H,1-6H2,(H,15,16)