O3-ethyl O1-methyl 2-azanylidenebenzimidazole-1,3-dicarboxylate

Systemtic Name: O3-ethyl O1-methyl 2-azanylidenebenzimidazole-1,3-dicarboxylate Openeye Name: O3-ethyl O1-methyl 2-iminobenzimidazole-1,3-dicarboxylate CAS Name: 2-iminobenzimidazole-1,3-dicarboxylic acid O3-ethyl ester O1-methyl ester IUPAC Name: 3-O-ethyl 1-O-methyl 2-iminobenzimidazole-1,3-dicarboxylate Traditional Name: 2-iminobenzimidazole-1,3-dicarboxylic acid O3-ethyl ester O1-methyl ester Formula: C12H13N3O4 MolecularWeight: 263.24932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=CC=CC=C2N(C1=N)C(=O)OC

Isomeric SMILES

CCOC(=O)N1C2=CC=CC=C2N(C1=N)C(=O)OC

InChI

InChI=1S/C12H13N3O4/c1-3-19-12(17)15-9-7-5-4-6-8(9)14(10(15)13)11(16)18-2/h4-7,13H,3H2,1-2H3