N,N-bis(cyanomethyl)-1-(3,5-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N,N-bis(cyanomethyl)-1-(3,5-dimethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N,N-bis(cyanomethyl)-1-(3,5-dimethylphenyl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: N,N-bis(cyanomethyl)-1-(3,5-dimethylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N,N-bis(cyanomethyl)-1-(3,5-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N,N-bis(cyanomethyl)-1-(3,5-dimethylphenyl)-5-keto-pyrrolidine-3-carboxamide Formula: C17H18N4O2 MolecularWeight: 310.35042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2CC(CC2=O)C(=O)N(CC#N)CC#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2CC(CC2=O)C(=O)N(CC#N)CC#N)C

InChI

InChI=1S/C17H18N4O2/c1-12-7-13(2)9-15(8-12)21-11-14(10-16(21)22)17(23)20(5-3-18)6-4-19/h7-9,14H,5-6,10-11H2,1-2H3