3-(3-bromanylpropylamino)-4-(2,2-dimethylpropoxy)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(3-bromanylpropylamino)-4-(2,2-dimethylpropoxy)cyclobut-3-ene-1,2-dione Openeye Name: 3-(3-bromopropylamino)-4-(2,2-dimethylpropoxy)cyclobut-3-ene-1,2-dione CAS Name: 3-(3-bromopropylamino)-4-(2,2-dimethylpropoxy)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(3-bromopropylamino)-4-(2,2-dimethylpropoxy)cyclobut-3-ene-1,2-dione Traditional Name: 3-(3-bromopropylamino)-4-neopentyloxy-cyclobut-3-ene-1,2-quinone Formula: C12H18BrNO3 MolecularWeight: 304.18022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)COC1=C(C(=O)C1=O)NCCCBr

Isomeric SMILES

CC(C)(C)COC1=C(C(=O)C1=O)NCCCBr

InChI

InChI=1S/C12H18BrNO3/c1-12(2,3)7-17-11-8(9(15)10(11)16)14-6-4-5-13/h14H,4-7H2,1-3H3