ethyl 4-(2-imidazol-1-ylethoxy)-3-(2-oxidanylideneethoxy)benzoate

Systemtic Name: ethyl 4-(2-imidazol-1-ylethoxy)-3-(2-oxidanylideneethoxy)benzoate Openeye Name: ethyl 4-(2-imidazol-1-ylethoxy)-3-(2-oxoethoxy)benzoate CAS Name: 4-[2-(1-imidazolyl)ethoxy]-3-(2-oxoethoxy)benzoic acid ethyl ester IUPAC Name: ethyl 4-(2-imidazol-1-ylethoxy)-3-(2-oxoethoxy)benzoate Traditional Name: 4-(2-imidazol-1-ylethoxy)-3-(2-ketoethoxy)benzoic acid ethyl ester Formula: C16H18N2O5 MolecularWeight: 318.32452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)OCCN2C=CN=C2)OCC=O

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)OCCN2C=CN=C2)OCC=O

InChI

InChI=1S/C16H18N2O5/c1-2-21-16(20)13-3-4-14(15(11-13)23-10-8-19)22-9-7-18-6-5-17-12-18/h3-6,8,11-12H,2,7,9-10H2,1H3