methyl 4-(4-bromophenyl)-2-imidazol-1-yl-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(4-bromophenyl)-2-imidazol-1-yl-4-oxidanylidene-butanoate Openeye Name: methyl 4-(4-bromophenyl)-2-imidazol-1-yl-4-oxo-butanoate CAS Name: 4-(4-bromophenyl)-2-(1-imidazolyl)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(4-bromophenyl)-2-imidazol-1-yl-4-oxobutanoate Traditional Name: 4-(4-bromophenyl)-2-imidazol-1-yl-4-keto-butyric acid methyl ester Formula: C14H13BrN2O3 MolecularWeight: 337.16862

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC(=O)C1=CC=C(C=C1)Br)N2C=CN=C2

Isomeric SMILES

COC(=O)C(CC(=O)C1=CC=C(C=C1)Br)N2C=CN=C2

InChI

InChI=1S/C14H13BrN2O3/c1-20-14(19)12(17-7-6-16-9-17)8-13(18)10-2-4-11(15)5-3-10/h2-7,9,12H,8H2,1H3