(3S,4aS,8E)-3-ethoxy-8-propylidene-3,4,4a,5,6,7-hexahydroisochromene

Systemtic Name: (3S,4aS,8E)-3-ethoxy-8-propylidene-3,4,4a,5,6,7-hexahydroisochromene Openeye Name: (3S,4aS,8E)-3-ethoxy-8-propylidene-3,4,4a,5,6,7-hexahydroisochromene CAS Name: (3S,4aS,8E)-3-ethoxy-8-propylidene-3,4,4a,5,6,7-hexahydro-2-benzopyran IUPAC Name: (3S,4aS,8E)-3-ethoxy-8-propylidene-3,4,4a,5,6,7-hexahydroisochromene Traditional Name: (3S,4aS,8E)-3-ethoxy-8-propylidene-3,4,4a,5,6,7-hexahydroisochromene Formula: C14H22O2 MolecularWeight: 222.32328

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Descriptors Computed from Structure

Canonical SMILES:

CCC=C1CCCC2C1=COC(C2)OCC

Isomeric SMILES

CC/C=C/1\CCC[C@@H]2C1=CO[C@@H](C2)OCC

InChI

InChI=1S/C14H22O2/c1-3-6-11-7-5-8-12-9-14(15-4-2)16-10-13(11)12/h6,10,12,14H,3-5,7-9H2,1-2H3/b11-6+/t12-,14-/m0/s1