9-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-8,10-bis(oxidanylidene)-9-azaspiro[5.5]undecane-7,11-dicarbonitrile

Systemtic Name: 9-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-8,10-bis(oxidanylidene)-9-azaspiro[5.5]undecane-7,11-dicarbonitrile Openeye Name: 8,10-dioxo-9-[2-oxo-2-(p-tolyl)ethyl]-9-azaspiro[5.5]undecane-7,11-dicarbonitrile CAS Name: 9-[2-(4-methylphenyl)-2-oxoethyl]-8,10-dioxo-9-azaspiro[5.5]undecane-7,11-dicarbonitrile IUPAC Name: 9-[2-(4-methylphenyl)-2-oxoethyl]-8,10-dioxo-9-azaspiro[5.5]undecane-7,11-dicarbonitrile Traditional Name: 8,10-diketo-9-[2-keto-2-(p-tolyl)ethyl]-9-azaspiro[5.5]undecane-7,11-dicarbonitrile Formula: C21H21N3O3 MolecularWeight: 363.40974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CN2C(=O)C(C3(CCCCC3)C(C2=O)C#N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CN2C(=O)C(C3(CCCCC3)C(C2=O)C#N)C#N

InChI

InChI=1S/C21H21N3O3/c1-14-5-7-15(8-6-14)18(25)13-24-19(26)16(11-22)21(9-3-2-4-10-21)17(12-23)20(24)27/h5-8,16-17H,2-4,9-10,13H2,1H3