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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1CN(C2=CC(=O)C2=O)NC(C)(C)CC)C#N

Isomeric SMILES

CCC1=CC=CC(=C1CN(C2=CC(=O)C2=O)NC(C)(C)CC)C#N

InChI

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