3-(4-bromophenyl)-4-(butylamino)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(4-bromophenyl)-4-(butylamino)cyclobut-3-ene-1,2-dione Openeye Name: 3-(4-bromophenyl)-4-(butylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(4-bromophenyl)-4-(butylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(4-bromophenyl)-4-(butylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(4-bromophenyl)-4-(butylamino)cyclobut-3-ene-1,2-quinone Formula: C14H14BrNO2 MolecularWeight: 308.17046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=O)C1=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCNC1=C(C(=O)C1=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C14H14BrNO2/c1-2-3-8-16-12-11(13(17)14(12)18)9-4-6-10(15)7-5-9/h4-7,16H,2-3,8H2,1H3