1-(2-chloroethyl)-4,4-dimethyl-1,3-dihydroisochromene

Systemtic Name: 1-(2-chloroethyl)-4,4-dimethyl-1,3-dihydroisochromene Openeye Name: 1-(2-chloroethyl)-4,4-dimethyl-isochromane CAS Name: 1-(2-chloroethyl)-4,4-dimethyl-3,4-dihydro-1H-2-benzopyran IUPAC Name: 1-(2-chloroethyl)-4,4-dimethyl-1,3-dihydroisochromene Traditional Name: 1-(2-chloroethyl)-4,4-dimethyl-isochroman Formula: C13H17ClO MolecularWeight: 224.72648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(C2=CC=CC=C21)CCCl)C

Isomeric SMILES

CC1(COC(C2=CC=CC=C21)CCCl)C

InChI

InChI=1S/C13H17ClO/c1-13(2)9-15-12(7-8-14)10-5-3-4-6-11(10)13/h3-6,12H,7-9H2,1-2H3