2-[2-[[(2-oxidanylideneazepan-3-yl)amino]methyl]phenoxy]ethanenitrile

Systemtic Name: 2-[2-[[(2-oxidanylideneazepan-3-yl)amino]methyl]phenoxy]ethanenitrile Openeye Name: 2-[2-[[(2-oxoazepan-3-yl)amino]methyl]phenoxy]acetonitrile CAS Name: 2-[2-[[(2-oxo-3-azepanyl)amino]methyl]phenoxy]acetonitrile IUPAC Name: 2-[2-[[(2-oxoazepan-3-yl)amino]methyl]phenoxy]acetonitrile Traditional Name: 2-[2-[[(2-ketoazepan-3-yl)amino]methyl]phenoxy]acetonitrile Formula: C15H19N3O2 MolecularWeight: 273.33026

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=CC=CC=C2OCC#N

Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=CC=CC=C2OCC#N

InChI

InChI=1S/C15H19N3O2/c16-8-10-20-14-7-2-1-5-12(14)11-18-13-6-3-4-9-17-15(13)19/h1-2,5,7,13,18H,3-4,6,9-11H2,(H,17,19)