3-[(4-bromanyl-2,6-dimethyl-phenyl)methylamino]-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[(4-bromanyl-2,6-dimethyl-phenyl)methylamino]-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-[(4-bromo-2,6-dimethyl-phenyl)methylamino]-4-(1,1-dimethylpropylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-[(4-bromo-2,6-dimethylphenyl)methylamino]-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[(4-bromo-2,6-dimethylphenyl)methylamino]-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(tert-amylamino)-4-[(4-bromo-2,6-dimethyl-benzyl)amino]cyclobut-3-ene-1,2-quinone Formula: C18H23BrN2O2 MolecularWeight: 379.29142

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC1=C(C(=O)C1=O)NCC2=C(C=C(C=C2C)Br)C

Isomeric SMILES

CCC(C)(C)NC1=C(C(=O)C1=O)NCC2=C(C=C(C=C2C)Br)C

InChI

InChI=1S/C18H23BrN2O2/c1-6-18(4,5)21-15-14(16(22)17(15)23)20-9-13-10(2)7-12(19)8-11(13)3/h7-8,20-21H,6,9H2,1-5H3