[1-oxidanylidene-1-(pyridin-3-ylamino)propan-2-yl] 1,3-benzoxazole-4-carboxylate

Systemtic Name: [1-oxidanylidene-1-(pyridin-3-ylamino)propan-2-yl] 1,3-benzoxazole-4-carboxylate Openeye Name: [1-methyl-2-oxo-2-(3-pyridylamino)ethyl] 1,3-benzoxazole-4-carboxylate CAS Name: 1,3-benzoxazole-4-carboxylic acid [1-oxo-1-(3-pyridinylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(pyridin-3-ylamino)propan-2-yl] 1,3-benzoxazole-4-carboxylate Traditional Name: 1,3-benzoxazole-4-carboxylic acid [2-keto-1-methyl-2-(3-pyridylamino)ethyl] ester Formula: C16H13N3O4 MolecularWeight: 311.29212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CN=CC=C1)OC(=O)C2=C3C(=CC=C2)OC=N3

Isomeric SMILES

CC(C(=O)NC1=CN=CC=C1)OC(=O)C2=C3C(=CC=C2)OC=N3

InChI

InChI=1S/C16H13N3O4/c1-10(15(20)19-11-4-3-7-17-8-11)23-16(21)12-5-2-6-13-14(12)18-9-22-13/h2-10H,1H3,(H,19,20)