O1-ethyl O6-(imidazol-1-ylmethyl) hexanedioate

Systemtic Name: O1-ethyl O6-(imidazol-1-ylmethyl) hexanedioate Openeye Name: O1-ethyl O6-(imidazol-1-ylmethyl) hexanedioate CAS Name: hexanedioic acid O1-ethyl ester O6-(1-imidazolylmethyl) ester IUPAC Name: 1-O-ethyl 6-O-(imidazol-1-ylmethyl) hexanedioate Traditional Name: adipic acid O1-ethyl ester O6-(imidazol-1-ylmethyl) ester Formula: C12H18N2O4 MolecularWeight: 254.28232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC(=O)OCN1C=CN=C1

Isomeric SMILES

CCOC(=O)CCCCC(=O)OCN1C=CN=C1

InChI

InChI=1S/C12H18N2O4/c1-2-17-11(15)5-3-4-6-12(16)18-10-14-8-7-13-9-14/h7-9H,2-6,10H2,1H3