2-[(4-chlorophenyl)methyl]-1-(phenylmethyl)azepane

Systemtic Name: 2-[(4-chlorophenyl)methyl]-1-(phenylmethyl)azepane Openeye Name: 1-benzyl-2-[(4-chlorophenyl)methyl]azepane CAS Name: 2-[(4-chlorophenyl)methyl]-1-(phenylmethyl)azepane IUPAC Name: 1-benzyl-2-[(4-chlorophenyl)methyl]azepane Traditional Name: 1-benzyl-2-(4-chlorobenzyl)azepane Formula: C20H24ClN MolecularWeight: 313.86426

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(N(CC1)CC2=CC=CC=C2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCC(N(CC1)CC2=CC=CC=C2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H24ClN/c21-19-12-10-17(11-13-19)15-20-9-5-2-6-14-22(20)16-18-7-3-1-4-8-18/h1,3-4,7-8,10-13,20H,2,5-6,9,14-16H2