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

Systemtic Name: 3-ethyl-4-[[[2-(2-methylbutan-2-ylamino)-3,4-bis(oxidanylidene)cyclobuten-1-yl]amino]methyl]benzenecarbonitrile Openeye Name: 4-[[[2-(1,1-dimethylpropylamino)-3,4-dioxo-cyclobuten-1-yl]amino]methyl]-3-ethyl-benzonitrile CAS Name: 3-ethyl-4-[[[2-(2-methylbutan-2-ylamino)-3,4-dioxo-1-cyclobutenyl]amino]methyl]benzonitrile IUPAC Name: 3-ethyl-4-[[[2-(2-methylbutan-2-ylamino)-3,4-dioxocyclobuten-1-yl]amino]methyl]benzonitrile Traditional Name: 4-[[[2-(tert-amylamino)-3,4-diketo-cyclobuten-1-yl]amino]methyl]-3-ethyl-benzonitrile Formula: C19H23N3O2 MolecularWeight: 325.40482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23N3O2/c1-5-13-9-12(10-20)7-8-14(13)11-21-15-16(18(24)17(15)23)22-19(3,4)6-2/h7-9,21-22H,5-6,11H2,1-4H3