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

Systemtic Name: 3-[[2-(azepan-1-yl)-2-oxidanylidene-ethyl]amino]benzenecarbonitrile Openeye Name: 3-[[2-(azepan-1-yl)-2-oxo-ethyl]amino]benzonitrile CAS Name: 3-[[2-(1-azepanyl)-2-oxoethyl]amino]benzonitrile IUPAC Name: 3-[[2-(azepan-1-yl)-2-oxoethyl]amino]benzonitrile Traditional Name: 3-[[2-(azepan-1-yl)-2-keto-ethyl]amino]benzonitrile Formula: C15H19N3O MolecularWeight: 257.33086

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CNC2=CC=CC(=C2)C#N

Isomeric SMILES

C1CCCN(CC1)C(=O)CNC2=CC=CC(=C2)C#N

InChI

InChI=1S/C15H19N3O/c16-11-13-6-5-7-14(10-13)17-12-15(19)18-8-3-1-2-4-9-18/h5-7,10,17H,1-4,8-9,12H2