5-[(2S)-2-methylhex-5-enyl]furan-3-carboxylic acid

Systemtic Name: 5-[(2S)-2-methylhex-5-enyl]furan-3-carboxylic acid Openeye Name: 5-[(2S)-2-methylhex-5-enyl]furan-3-carboxylic acid CAS Name: 5-[(2S)-2-methylhex-5-enyl]-3-furancarboxylic acid IUPAC Name: 5-[(2S)-2-methylhex-5-enyl]furan-3-carboxylic acid Traditional Name: 5-[(2S)-2-methylhex-5-enyl]-3-furoic acid Formula: C12H16O3 MolecularWeight: 208.25364

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C)CC1=CC(=CO1)C(=O)O

Isomeric SMILES

C[C@@H](CCC=C)CC1=CC(=CO1)C(=O)O

InChI

InChI=1S/C12H16O3/c1-3-4-5-9(2)6-11-7-10(8-15-11)12(13)14/h3,7-9H,1,4-6H2,2H3,(H,13,14)/t9-/m0/s1