3-[(2,4-dichlorophenyl)methylamino]-4-(3,3-dimethylbutan-2-ylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(2,4-dichlorophenyl)methylamino]-4-(3,3-dimethylbutan-2-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-[(2,4-dichlorophenyl)methylamino]-4-(1,2,2-trimethylpropylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-[(2,4-dichlorophenyl)methylamino]-4-(3,3-dimethylbutan-2-ylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[(2,4-dichlorophenyl)methylamino]-4-(3,3-dimethylbutan-2-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-[(2,4-dichlorobenzyl)amino]-4-(1,2,2-trimethylpropylamino)cyclobut-3-ene-1,2-quinone Formula: C17H20Cl2N2O2 MolecularWeight: 355.2589

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C)(C)C)NC1=C(C(=O)C1=O)NCC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C(C)(C)C)NC1=C(C(=O)C1=O)NCC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H20Cl2N2O2/c1-9(17(2,3)4)21-14-13(15(22)16(14)23)20-8-10-5-6-11(18)7-12(10)19/h5-7,9,20-21H,8H2,1-4H3