2-bromanyl-4-chloranyl-6-[[(1-octylbenzimidazol-2-yl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 2-bromanyl-4-chloranyl-6-[[(1-octylbenzimidazol-2-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 2-bromo-4-chloro-6-[[(1-octylbenzimidazol-2-yl)amino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 2-bromo-4-chloro-6-[[(1-octyl-2-benzimidazolyl)amino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 2-bromo-4-chloro-6-[[(1-octylbenzimidazol-2-yl)amino]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 2-bromo-4-chloro-6-[[(1-octylbenzimidazol-2-yl)amino]methylene]cyclohexa-2,4-dien-1-one Formula: C22H25BrClN3O MolecularWeight: 462.8104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=CC=CC=C2N=C1NC=C3C=C(C=C(C3=O)Br)Cl

Isomeric SMILES

CCCCCCCCN1C2=CC=CC=C2N=C1NC=C3C=C(C=C(C3=O)Br)Cl

InChI

InChI=1S/C22H25BrClN3O/c1-2-3-4-5-6-9-12-27-20-11-8-7-10-19(20)26-22(27)25-15-16-13-17(24)14-18(23)21(16)28/h7-8,10-11,13-15H,2-6,9,12H2,1H3,(H,25,26)