tert-butyl (3E)-3-[[1-(3-methylbutyl)imidazol-4-yl]methylidene]-2-oxidanylidene-piperidine-1-carboxylate

Systemtic Name: tert-butyl (3E)-3-[[1-(3-methylbutyl)imidazol-4-yl]methylidene]-2-oxidanylidene-piperidine-1-carboxylate Openeye Name: tert-butyl (3E)-3-[(1-isopentylimidazol-4-yl)methylene]-2-oxo-piperidine-1-carboxylate CAS Name: (3E)-3-[[1-(3-methylbutyl)-4-imidazolyl]methylidene]-2-oxo-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3E)-3-[[1-(3-methylbutyl)imidazol-4-yl]methylidene]-2-oxopiperidine-1-carboxylate Traditional Name: (3E)-3-[(1-isoamylimidazol-4-yl)methylene]-2-keto-piperidine-1-carboxylic acid tert-butyl ester Formula: C19H29N3O3 MolecularWeight: 347.45186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C=C(N=C1)C=C2CCCN(C2=O)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CCN1C=C(N=C1)/C=C/2\CCCN(C2=O)C(=O)OC(C)(C)C

InChI

InChI=1S/C19H29N3O3/c1-14(2)8-10-21-12-16(20-13-21)11-15-7-6-9-22(17(15)23)18(24)25-19(3,4)5/h11-14H,6-10H2,1-5H3/b15-11+