2-[(11-oxidanylidene-4,10-diazaspiro[5.5]undecan-10-yl)methyl]benzenecarbonitrile

Systemtic Name: 2-[(11-oxidanylidene-4,10-diazaspiro[5.5]undecan-10-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(11-oxo-4,10-diazaspiro[5.5]undecan-10-yl)methyl]benzonitrile CAS Name: 2-[(11-oxo-4,10-diazaspiro[5.5]undecan-10-yl)methyl]benzonitrile IUPAC Name: 2-[(11-oxo-4,10-diazaspiro[5.5]undecan-10-yl)methyl]benzonitrile Traditional Name: 2-[(11-keto-4,10-diazaspiro[5.5]undecan-10-yl)methyl]benzonitrile Formula: C17H21N3O MolecularWeight: 283.36814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCCN(C2=O)CC3=CC=CC=C3C#N)CNC1

Isomeric SMILES

C1CC2(CCCN(C2=O)CC3=CC=CC=C3C#N)CNC1

InChI

InChI=1S/C17H21N3O/c18-11-14-5-1-2-6-15(14)12-20-10-4-8-17(16(20)21)7-3-9-19-13-17/h1-2,5-6,19H,3-4,7-10,12-13H2