2-(4-phenylmethoxybutanoylamino)pyridine-3-carboxylic acid

Systemtic Name: 2-(4-phenylmethoxybutanoylamino)pyridine-3-carboxylic acid Openeye Name: 2-(4-benzyloxybutanoylamino)pyridine-3-carboxylic acid CAS Name: 2-[(1-oxo-4-phenylmethoxybutyl)amino]-3-pyridinecarboxylic acid IUPAC Name: 2-(4-phenylmethoxybutanoylamino)pyridine-3-carboxylic acid Traditional Name: 2-(4-benzoxybutanoylamino)nicotinic acid Formula: C17H18N2O4 MolecularWeight: 314.33582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCCCC(=O)NC2=C(C=CC=N2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COCCCC(=O)NC2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C17H18N2O4/c20-15(19-16-14(17(21)22)8-4-10-18-16)9-5-11-23-12-13-6-2-1-3-7-13/h1-4,6-8,10H,5,9,11-12H2,(H,21,22)(H,18,19,20)