3-[(1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzonitrile CAS Name: 3-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzonitrile IUPAC Name: 3-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzonitrile Traditional Name: 3-[(1-keto-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzonitrile Formula: C21H22N4O MolecularWeight: 346.42558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H22N4O/c22-14-17-5-4-6-18(13-17)15-24-11-9-21(10-12-24)20(26)23-16-25(21)19-7-2-1-3-8-19/h1-8,13H,9-12,15-16H2,(H,23,26)