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

Systemtic Name: 4-[(11-oxidanylidene-4,10-diazaspiro[5.5]undecan-10-yl)methyl]benzenecarbonitrile hydrochloride Openeye Name: 4-[(11-oxo-4,10-diazaspiro[5.5]undecan-10-yl)methyl]benzonitrile hydrochloride CAS Name: 4-[(11-oxo-4,10-diazaspiro[5.5]undecan-10-yl)methyl]benzonitrile hydrochloride IUPAC Name: 4-[(11-oxo-4,10-diazaspiro[5.5]undecan-10-yl)methyl]benzonitrile hydrochloride Traditional Name: 4-[(11-keto-4,10-diazaspiro[5.5]undecan-10-yl)methyl]benzonitrile hydrochloride Formula: C17H22ClN3O MolecularWeight: 319.82908

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCCN(C2=O)CC3=CC=C(C=C3)C#N)CNC1.Cl

Isomeric SMILES

C1CC2(CCCN(C2=O)CC3=CC=C(C=C3)C#N)CNC1.Cl

InChI

InChI=1S/C17H21N3O.ClH/c18-11-14-3-5-15(6-4-14)12-20-10-2-8-17(16(20)21)7-1-9-19-13-17;/h3-6,19H,1-2,7-10,12-13H2;1H