hexanal; (E)-hex-2-enal; pent-1-en-3-ol; (E)-pent-2-en-1-ol

Systemtic Name: hexanal; (E)-hex-2-enal; pent-1-en-3-ol; (E)-pent-2-en-1-ol Openeye Name: hexanal; (E)-hex-2-enal; pent-1-en-3-ol; (E)-pent-2-en-1-ol CAS Name: hexanal; (E)-2-hexenal; 1-penten-3-ol; (E)-2-penten-1-ol IUPAC Name: hexanal; (E)-hex-2-enal; pent-1-en-3-ol; (E)-pent-2-en-1-ol Traditional Name: hexanal; (E)-hex-2-enal; pent-1-en-3-ol; (E)-pent-2-en-1-ol Formula: C22H42O4 MolecularWeight: 370.56648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=O.CCCC=CC=O.CCC=CCO.CCC(C=C)O

Isomeric SMILES

CCCCCC=O.CCC/C=C/C=O.CC/C=C/CO.CCC(C=C)O

InChI

InChI=1S/C6H12O.C6H10O.2C5H10O/c2*1-2-3-4-5-6-7;1-3-5(6)4-2;1-2-3-4-5-6/h6H,2-5H2,1H3;4-6H,2-3H2,1H3;3,5-6H,1,4H2,2H3;3-4,6H,2,5H2,1H3/b;5-4+;;4-3+