tert-butyl (E)-3-cyano-2-ethyl-4-(3-methylimidazol-4-yl)but-3-enoate

Systemtic Name: tert-butyl (E)-3-cyano-2-ethyl-4-(3-methylimidazol-4-yl)but-3-enoate Openeye Name: tert-butyl (E)-3-cyano-2-ethyl-4-(3-methylimidazol-4-yl)but-3-enoate CAS Name: (E)-3-cyano-2-ethyl-4-(3-methyl-4-imidazolyl)-3-butenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-3-cyano-2-ethyl-4-(3-methylimidazol-4-yl)but-3-enoate Traditional Name: (E)-3-cyano-2-ethyl-4-(3-methylimidazol-4-yl)but-3-enoic acid tert-butyl ester Formula: C15H21N3O2 MolecularWeight: 275.34614

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=CC1=CN=CN1C)C#N)C(=O)OC(C)(C)C

Isomeric SMILES

CCC(/C(=C\C1=CN=CN1C)/C#N)C(=O)OC(C)(C)C

InChI

InChI=1S/C15H21N3O2/c1-6-13(14(19)20-15(2,3)4)11(8-16)7-12-9-17-10-18(12)5/h7,9-10,13H,6H2,1-5H3/b11-7-