tert-butyl 2-butyl-4-[(E)-4-ethoxy-4-oxidanylidene-1-phenyl-but-2-en-2-yl]imidazole-1-carboxylate

Systemtic Name: tert-butyl 2-butyl-4-[(E)-4-ethoxy-4-oxidanylidene-1-phenyl-but-2-en-2-yl]imidazole-1-carboxylate Openeye Name: tert-butyl 4-[(E)-1-benzyl-3-ethoxy-3-oxo-prop-1-enyl]-2-butyl-imidazole-1-carboxylate CAS Name: 2-butyl-4-[(E)-4-ethoxy-4-oxo-1-phenylbut-2-en-2-yl]-1-imidazolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-butyl-4-[(E)-4-ethoxy-4-oxo-1-phenylbut-2-en-2-yl]imidazole-1-carboxylate Traditional Name: 4-[(E)-1-benzyl-3-ethoxy-3-keto-prop-1-enyl]-2-butyl-imidazole-1-carboxylic acid tert-butyl ester Formula: C24H32N2O4 MolecularWeight: 412.52188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CN1C(=O)OC(C)(C)C)C(=CC(=O)OCC)CC2=CC=CC=C2

Isomeric SMILES

CCCCC1=NC(=CN1C(=O)OC(C)(C)C)/C(=C/C(=O)OCC)/CC2=CC=CC=C2

InChI

InChI=1S/C24H32N2O4/c1-6-8-14-21-25-20(17-26(21)23(28)30-24(3,4)5)19(16-22(27)29-7-2)15-18-12-10-9-11-13-18/h9-13,16-17H,6-8,14-15H2,1-5H3/b19-16+