pyridin-3-yl 2-methyl-4-(tridecylamino)benzoate

Systemtic Name: pyridin-3-yl 2-methyl-4-(tridecylamino)benzoate Openeye Name: 3-pyridyl 2-methyl-4-(tridecylamino)benzoate CAS Name: 2-methyl-4-(tridecylamino)benzoic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl 2-methyl-4-(tridecylamino)benzoate Traditional Name: 2-methyl-4-(tridecylamino)benzoic acid 3-pyridyl ester Formula: C26H38N2O2 MolecularWeight: 410.59212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCNC1=CC(=C(C=C1)C(=O)OC2=CN=CC=C2)C

Isomeric SMILES

CCCCCCCCCCCCCNC1=CC(=C(C=C1)C(=O)OC2=CN=CC=C2)C

InChI

InChI=1S/C26H38N2O2/c1-3-4-5-6-7-8-9-10-11-12-13-19-28-23-16-17-25(22(2)20-23)26(29)30-24-15-14-18-27-21-24/h14-18,20-21,28H,3-13,19H2,1-2H3