4-(4-chloranylphenoxy)-3-methyl-azepane

Systemtic Name: 4-(4-chloranylphenoxy)-3-methyl-azepane Openeye Name: 4-(4-chlorophenoxy)-3-methyl-azepane CAS Name: 4-(4-chlorophenoxy)-3-methylazepane IUPAC Name: 4-(4-chlorophenoxy)-3-methylazepane Traditional Name: 4-(4-chlorophenoxy)-3-methyl-azepane Formula: C13H18ClNO MolecularWeight: 239.74112

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Descriptors Computed from Structure

Canonical SMILES:

CC1CNCCCC1OC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1CNCCCC1OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H18ClNO/c1-10-9-15-8-2-3-13(10)16-12-6-4-11(14)5-7-12/h4-7,10,13,15H,2-3,8-9H2,1H3