2,7-bis(chloromethyl)-1-(phenylmethyl)azepane

Systemtic Name: 2,7-bis(chloromethyl)-1-(phenylmethyl)azepane Openeye Name: 1-benzyl-2,7-bis(chloromethyl)azepane CAS Name: 2,7-bis(chloromethyl)-1-(phenylmethyl)azepane IUPAC Name: 1-benzyl-2,7-bis(chloromethyl)azepane Traditional Name: 1-benzyl-2,7-bis(chloromethyl)azepane Formula: C15H21Cl2N MolecularWeight: 286.23994

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(N(C(C1)CCl)CC2=CC=CC=C2)CCl

Isomeric SMILES

C1CCC(N(C(C1)CCl)CC2=CC=CC=C2)CCl

InChI

InChI=1S/C15H21Cl2N/c16-10-14-8-4-5-9-15(11-17)18(14)12-13-6-2-1-3-7-13/h1-3,6-7,14-15H,4-5,8-12H2