heptan-2-ol; 3-methylheptan-4-ol; (E)-pent-3-en-2-ol

Systemtic Name: heptan-2-ol; 3-methylheptan-4-ol; (E)-pent-3-en-2-ol Openeye Name: heptan-2-ol; 3-methylheptan-4-ol; (E)-pent-3-en-2-ol CAS Name: 2-heptanol; 3-methyl-4-heptanol; (E)-3-penten-2-ol IUPAC Name: heptan-2-ol; 3-methylheptan-4-ol; (E)-pent-3-en-2-ol Traditional Name: heptan-2-ol; 3-methylheptan-4-ol; (E)-pent-3-en-2-ol Formula: C20H44O3 MolecularWeight: 332.56156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCC(C)O.CCCC(C(C)CC)O.C/C=C/C(C)O

InChI

InChI=1S/C8H18O.C7H16O.C5H10O/c1-4-6-8(9)7(3)5-2;1-3-4-5-6-7(2)8;1-3-4-5(2)6/h7-9H,4-6H2,1-3H3;7-8H,3-6H2,1-2H3;3-6H,1-2H3/b;;4-3+