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

Systemtic Name: 3-[(2-chloranyl-4,6-dimethyl-phenyl)methylamino]-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-[(2-chloro-4,6-dimethyl-phenyl)methylamino]-4-(1,1-dimethylpropylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-[(2-chloro-4,6-dimethylphenyl)methylamino]-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-[(2-chloro-4,6-dimethylphenyl)methylamino]-4-(2-methylbutan-2-ylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(tert-amylamino)-4-[(2-chloro-4,6-dimethyl-benzyl)amino]cyclobut-3-ene-1,2-quinone Formula: C18H23ClN2O2 MolecularWeight: 334.84042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)NC1=C(C(=O)C1=O)NCC2=C(C=C(C=C2Cl)C)C

Isomeric SMILES

CCC(C)(C)NC1=C(C(=O)C1=O)NCC2=C(C=C(C=C2Cl)C)C

InChI

InChI=1S/C18H23ClN2O2/c1-6-18(4,5)21-15-14(16(22)17(15)23)20-9-12-11(3)7-10(2)8-13(12)19/h7-8,20-21H,6,9H2,1-5H3