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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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