1-[2-(5-chloranyl-2-ethoxy-phenyl)-3-methyl-pentyl]azepane

Systemtic Name: 1-[2-(5-chloranyl-2-ethoxy-phenyl)-3-methyl-pentyl]azepane Openeye Name: 1-[2-(5-chloro-2-ethoxy-phenyl)-3-methyl-pentyl]azepane CAS Name: 1-[2-(5-chloro-2-ethoxyphenyl)-3-methylpentyl]azepane IUPAC Name: 1-[2-(5-chloro-2-ethoxyphenyl)-3-methylpentyl]azepane Traditional Name: 1-[2-(5-chloro-2-ethoxy-phenyl)-3-methyl-pentyl]azepane Formula: C20H32ClNO MolecularWeight: 337.92718

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(CN1CCCCCC1)C2=C(C=CC(=C2)Cl)OCC

Isomeric SMILES

CCC(C)C(CN1CCCCCC1)C2=C(C=CC(=C2)Cl)OCC

InChI

InChI=1S/C20H32ClNO/c1-4-16(3)19(15-22-12-8-6-7-9-13-22)18-14-17(21)10-11-20(18)23-5-2/h10-11,14,16,19H,4-9,12-13,15H2,1-3H3