3-[1-[(2-oxidanylideneazepan-3-yl)amino]ethyl]benzenecarbonitrile

Systemtic Name: 3-[1-[(2-oxidanylideneazepan-3-yl)amino]ethyl]benzenecarbonitrile Openeye Name: 3-[1-[(2-oxoazepan-3-yl)amino]ethyl]benzonitrile CAS Name: 3-[1-[(2-oxo-3-azepanyl)amino]ethyl]benzonitrile IUPAC Name: 3-[1-[(2-oxoazepan-3-yl)amino]ethyl]benzonitrile Traditional Name: 3-[1-[(2-ketoazepan-3-yl)amino]ethyl]benzonitrile Formula: C15H19N3O MolecularWeight: 257.33086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC(=C1)C#N)NC2CCCCNC2=O

Isomeric SMILES

CC(C1=CC=CC(=C1)C#N)NC2CCCCNC2=O

InChI

InChI=1S/C15H19N3O/c1-11(13-6-4-5-12(9-13)10-16)18-14-7-2-3-8-17-15(14)19/h4-6,9,11,14,18H,2-3,7-8H2,1H3,(H,17,19)