3-(3,4-dimethylphenyl)-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(3,4-dimethylphenyl)-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-(3,4-dimethylphenyl)-4-(1,1-dimethylpropylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(3,4-dimethylphenyl)-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(3,4-dimethylphenyl)-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(tert-amylamino)-4-(3,4-dimethylphenyl)cyclobut-3-ene-1,2-quinone Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC1=C(C(=O)C1=O)C2=CC(=C(C=C2)C)C

Isomeric SMILES

CCC(C)(C)NC1=C(C(=O)C1=O)C2=CC(=C(C=C2)C)C

InChI

InChI=1S/C17H21NO2/c1-6-17(4,5)18-14-13(15(19)16(14)20)12-8-7-10(2)11(3)9-12/h7-9,18H,6H2,1-5H3