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3-(pyridin-3-ylmethylamino)azepan-2-one

3-(pyridin-3-ylmethylamino)azepan-2-one

Systemtic Name:3-(pyridin-3-ylmethylamino)azepan-2-one
Openeye Name:3-(3-pyridylmethylamino)azepan-2-one
CAS Name:3-(3-pyridinylmethylamino)-2-azepanone
IUPAC Name:3-(pyridin-3-ylmethylamino)azepan-2-one
Traditional Name:3-(3-pyridylmethylamino)azepan-2-one
Formula: C12H17N3O
MolecularWeight: 219.28288
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C12H17N3O/c16-12-11(5-1-2-7-14-12)15-9-10-4-3-6-13-8-10/h3-4,6,8,11,15H,1-2,5,7,9H2,(H,14,16)


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