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3-[(3-chlorophenyl)methylamino]azepan-2-one

3-[(3-chlorophenyl)methylamino]azepan-2-one

Systemtic Name:3-[(3-chlorophenyl)methylamino]azepan-2-one
Openeye Name:3-[(3-chlorophenyl)methylamino]azepan-2-one
CAS Name:3-[(3-chlorophenyl)methylamino]-2-azepanone
IUPAC Name:3-[(3-chlorophenyl)methylamino]azepan-2-one
Traditional Name:3-[(3-chlorobenzyl)amino]azepan-2-one
Formula: C13H17ClN2O
MolecularWeight: 252.73988
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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=CC(=CC=C2)Cl


Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=CC(=CC=C2)Cl


InChI

InChI=1S/C13H17ClN2O/c14-11-5-3-4-10(8-11)9-16-12-6-1-2-7-15-13(12)17/h3-5,8,12,16H,1-2,6-7,9H2,(H,15,17)


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