4-[[[2-(tert-butylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]methyl]-2-ethyl-benzenecarbonitrile

Systemtic Name: 4-[[[2-(tert-butylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]methyl]-2-ethyl-benzenecarbonitrile Openeye Name: 4-[[[2-(tert-butylamino)-3,4-dioxo-cyclobuten-1-yl]amino]methyl]-2-ethyl-benzonitrile CAS Name: 4-[[[2-(tert-butylamino)-3,4-dioxo-1-cyclobutenyl]amino]methyl]-2-ethylbenzonitrile IUPAC Name: 4-[[[2-(tert-butylamino)-3,4-dioxocyclobuten-1-yl]amino]methyl]-2-ethylbenzonitrile Traditional Name: 4-[[[2-(tert-butylamino)-3,4-diketo-cyclobuten-1-yl]amino]methyl]-2-ethyl-benzonitrile Formula: C18H21N3O2 MolecularWeight: 311.37824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)CNC2=C(C(=O)C2=O)NC(C)(C)C)C#N

Isomeric SMILES

CCC1=C(C=CC(=C1)CNC2=C(C(=O)C2=O)NC(C)(C)C)C#N

InChI

InChI=1S/C18H21N3O2/c1-5-12-8-11(6-7-13(12)9-19)10-20-14-15(17(23)16(14)22)21-18(2,3)4/h6-8,20-21H,5,10H2,1-4H3