pentan-2-yl (E)-but-2-enoate

Systemtic Name: pentan-2-yl (E)-but-2-enoate Openeye Name: 1-methylbutyl (E)-but-2-enoate CAS Name: (E)-2-butenoic acid pentan-2-yl ester IUPAC Name: pentan-2-yl (E)-but-2-enoate Traditional Name: (E)-but-2-enoic acid 1-methylbutyl ester Formula: C9H16O2 MolecularWeight: 156.22214

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)OC(=O)C=CC

Isomeric SMILES

CCCC(C)OC(=O)/C=C/C

InChI

InChI=1S/C9H16O2/c1-4-6-8(3)11-9(10)7-5-2/h5,7-8H,4,6H2,1-3H3/b7-5+