tert-butyl 4-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-3-azabicyclo[2.1.1]hexane-3-carboxylate

Systemtic Name: tert-butyl 4-[(E)-3-ethoxy-3-oxidanylidene-prop-1-enyl]-3-azabicyclo[2.1.1]hexane-3-carboxylate Openeye Name: tert-butyl 4-[(E)-3-ethoxy-3-oxo-prop-1-enyl]-3-azabicyclo[2.1.1]hexane-3-carboxylate CAS Name: 4-[(E)-3-ethoxy-3-oxoprop-1-enyl]-3-azabicyclo[2.1.1]hexane-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(E)-3-ethoxy-3-oxoprop-1-enyl]-3-azabicyclo[2.1.1]hexane-3-carboxylate Traditional Name: 4-[(E)-3-ethoxy-3-keto-prop-1-enyl]-3-azabicyclo[2.1.1]hexane-3-carboxylic acid tert-butyl ester Formula: C15H23NO4 MolecularWeight: 281.34742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CC12CC(C1)CN2C(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)/C=C/C12CC(C1)CN2C(=O)OC(C)(C)C

InChI

InChI=1S/C15H23NO4/c1-5-19-12(17)6-7-15-8-11(9-15)10-16(15)13(18)20-14(2,3)4/h6-7,11H,5,8-10H2,1-4H3/b7-6+