2-[[(4-bromophenyl)amino]methylidene]-5-propyl-cyclohexane-1,3-dione

Systemtic Name: 2-[[(4-bromophenyl)amino]methylidene]-5-propyl-cyclohexane-1,3-dione Openeye Name: 2-[(4-bromoanilino)methylene]-5-propyl-cyclohexane-1,3-dione CAS Name: 2-[(4-bromoanilino)methylidene]-5-propylcyclohexane-1,3-dione IUPAC Name: 2-[(4-bromoanilino)methylidene]-5-propylcyclohexane-1,3-dione Traditional Name: 2-[(4-bromoanilino)methylene]-5-propyl-cyclohexane-1,3-quinone Formula: C16H18BrNO2 MolecularWeight: 336.22362

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC(=O)C(=CNC2=CC=C(C=C2)Br)C(=O)C1

Isomeric SMILES

CCCC1CC(=O)C(=CNC2=CC=C(C=C2)Br)C(=O)C1

InChI

InChI=1S/C16H18BrNO2/c1-2-3-11-8-15(19)14(16(20)9-11)10-18-13-6-4-12(17)5-7-13/h4-7,10-11,18H,2-3,8-9H2,1H3