3-[(4-oxidanylidene-3-phenyl-3,9-diazaspiro[4.5]decan-9-yl)sulfonyl]benzenecarbonitrile

Systemtic Name: 3-[(4-oxidanylidene-3-phenyl-3,9-diazaspiro[4.5]decan-9-yl)sulfonyl]benzenecarbonitrile Openeye Name: 3-[(4-oxo-3-phenyl-3,9-diazaspiro[4.5]decan-9-yl)sulfonyl]benzonitrile CAS Name: 3-[(4-oxo-3-phenyl-3,9-diazaspiro[4.5]decan-9-yl)sulfonyl]benzonitrile IUPAC Name: 3-[(4-oxo-3-phenyl-3,9-diazaspiro[4.5]decan-9-yl)sulfonyl]benzonitrile Traditional Name: 3-[(4-keto-3-phenyl-3,9-diazaspiro[4.5]decan-9-yl)sulfonyl]benzonitrile Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2(CCN(C2=O)C3=CC=CC=C3)CN(C1)S(=O)(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

C1CC2(CCN(C2=O)C3=CC=CC=C3)CN(C1)S(=O)(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C21H21N3O3S/c22-15-17-6-4-9-19(14-17)28(26,27)23-12-5-10-21(16-23)11-13-24(20(21)25)18-7-2-1-3-8-18/h1-4,6-9,14H,5,10-13,16H2