1-butan-2-yl-2-[(4-chlorophenyl)methyl]azepane

Systemtic Name: 1-butan-2-yl-2-[(4-chlorophenyl)methyl]azepane Openeye Name: 2-[(4-chlorophenyl)methyl]-1-sec-butyl-azepane CAS Name: 1-butan-2-yl-2-[(4-chlorophenyl)methyl]azepane IUPAC Name: 1-butan-2-yl-2-[(4-chlorophenyl)methyl]azepane Traditional Name: 2-(4-chlorobenzyl)-1-sec-butyl-azepane Formula: C17H26ClN MolecularWeight: 279.84804

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1CCCCCC1CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(C)N1CCCCCC1CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H26ClN/c1-3-14(2)19-12-6-4-5-7-17(19)13-15-8-10-16(18)11-9-15/h8-11,14,17H,3-7,12-13H2,1-2H3