methyl 3-but-3-enylbenzoate

Systemtic Name: methyl 3-but-3-enylbenzoate Openeye Name: methyl 3-but-3-enylbenzoate CAS Name: 3-but-3-enylbenzoic acid methyl ester IUPAC Name: methyl 3-but-3-enylbenzoate Traditional Name: 3-but-3-enylbenzoic acid methyl ester Formula: C12H14O2 MolecularWeight: 190.23836

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CCC=C

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CCC=C

InChI

InChI=1S/C12H14O2/c1-3-4-6-10-7-5-8-11(9-10)12(13)14-2/h3,5,7-9H,1,4,6H2,2H3