pentyl 4-(pyridin-4-ylcarbonylamino)benzoate

Systemtic Name: pentyl 4-(pyridin-4-ylcarbonylamino)benzoate Openeye Name: pentyl 4-(pyridine-4-carbonylamino)benzoate CAS Name: 4-[[oxo(pyridin-4-yl)methyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-(pyridine-4-carbonylamino)benzoate Traditional Name: 4-isonicotinamidobenzoic acid amyl ester Formula: C18H20N2O3 MolecularWeight: 312.363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=NC=C2

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=NC=C2

InChI

InChI=1S/C18H20N2O3/c1-2-3-4-13-23-18(22)15-5-7-16(8-6-15)20-17(21)14-9-11-19-12-10-14/h5-12H,2-4,13H2,1H3,(H,20,21)