1-[2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl]azepane

Systemtic Name: 1-[2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl]azepane Openeye Name: 1-[2-(2-allyl-4-chloro-phenoxy)ethyl]azepane CAS Name: 1-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]azepane IUPAC Name: 1-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]azepane Traditional Name: 1-[2-(2-allyl-4-chloro-phenoxy)ethyl]azepane Formula: C17H24ClNO MolecularWeight: 293.83156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=CC(=C1)Cl)OCCN2CCCCCC2

Isomeric SMILES

C=CCC1=C(C=CC(=C1)Cl)OCCN2CCCCCC2

InChI

InChI=1S/C17H24ClNO/c1-2-7-15-14-16(18)8-9-17(15)20-13-12-19-10-5-3-4-6-11-19/h2,8-9,14H,1,3-7,10-13H2