tert-butyl (2Z)-2-ethylidene-3-oxidanylidene-heptanoate

Systemtic Name: tert-butyl (2Z)-2-ethylidene-3-oxidanylidene-heptanoate Openeye Name: tert-butyl (2Z)-2-ethylidene-3-oxo-heptanoate CAS Name: (2Z)-2-ethylidene-3-oxoheptanoic acid tert-butyl ester IUPAC Name: tert-butyl (2Z)-2-ethylidene-3-oxoheptanoate Traditional Name: (Z)-2-valerylbut-2-enoic acid tert-butyl ester Formula: C13H22O3 MolecularWeight: 226.31198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C(=CC)C(=O)OC(C)(C)C

Isomeric SMILES

CCCCC(=O)/C(=C/C)/C(=O)OC(C)(C)C

InChI

InChI=1S/C13H22O3/c1-6-8-9-11(14)10(7-2)12(15)16-13(3,4)5/h7H,6,8-9H2,1-5H3/b10-7-