methyl 4-chloranyl-3-(pyridin-4-ylmethylamino)benzoate

Systemtic Name: methyl 4-chloranyl-3-(pyridin-4-ylmethylamino)benzoate Openeye Name: methyl 4-chloro-3-(4-pyridylmethylamino)benzoate CAS Name: 4-chloro-3-(pyridin-4-ylmethylamino)benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-(pyridin-4-ylmethylamino)benzoate Traditional Name: 4-chloro-3-(4-pyridylmethylamino)benzoic acid methyl ester Formula: C14H13ClN2O2 MolecularWeight: 276.71822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NCC2=CC=NC=C2

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NCC2=CC=NC=C2

InChI

InChI=1S/C14H13ClN2O2/c1-19-14(18)11-2-3-12(15)13(8-11)17-9-10-4-6-16-7-5-10/h2-8,17H,9H2,1H3