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

Systemtic Name: 2-[(1-oxidanylidene-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzenecarbonitrile Openeye Name: 2-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzonitrile CAS Name: 2-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzonitrile IUPAC Name: 2-[(1-oxo-4-phenyl-2,4,8-triazaspiro[4.5]decan-8-yl)methyl]benzonitrile Traditional Name: 2-[(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=C4C#N

Isomeric SMILES

C1CN(CCC12C(=O)NCN2C3=CC=CC=C3)CC4=CC=CC=C4C#N

InChI

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