3-[(3-chlorophenyl)methyl]-1-ethyl-1,2-diazepane

Systemtic Name: 3-[(3-chlorophenyl)methyl]-1-ethyl-1,2-diazepane Openeye Name: 3-[(3-chlorophenyl)methyl]-1-ethyl-diazepane CAS Name: 3-[(3-chlorophenyl)methyl]-1-ethyldiazepane IUPAC Name: 3-[(3-chlorophenyl)methyl]-1-ethyldiazepane Traditional Name: 3-(3-chlorobenzyl)-1-ethyl-diazepane Formula: C14H21ClN2 MolecularWeight: 252.78294

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCCC(N1)CC2=CC(=CC=C2)Cl

Isomeric SMILES

CCN1CCCCC(N1)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C14H21ClN2/c1-2-17-9-4-3-8-14(16-17)11-12-6-5-7-13(15)10-12/h5-7,10,14,16H,2-4,8-9,11H2,1H3