4-(3-chloranylphenoxy)-1,3-dimethyl-azepane

Systemtic Name: 4-(3-chloranylphenoxy)-1,3-dimethyl-azepane Openeye Name: 4-(3-chlorophenoxy)-1,3-dimethyl-azepane CAS Name: 4-(3-chlorophenoxy)-1,3-dimethylazepane IUPAC Name: 4-(3-chlorophenoxy)-1,3-dimethylazepane Traditional Name: 4-(3-chlorophenoxy)-1,3-dimethyl-azepane Formula: C14H20ClNO MolecularWeight: 253.7677

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCCC1OC2=CC(=CC=C2)Cl)C

Isomeric SMILES

CC1CN(CCCC1OC2=CC(=CC=C2)Cl)C

InChI

InChI=1S/C14H20ClNO/c1-11-10-16(2)8-4-7-14(11)17-13-6-3-5-12(15)9-13/h3,5-6,9,11,14H,4,7-8,10H2,1-2H3