2-[2-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzimidazol-1-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[2-[(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]benzimidazol-1-yl]ethyl-diethyl-azanium Openeye Name: 2-[2-[(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]benzimidazol-1-yl]ethyl-diethyl-ammonium CAS Name: 2-[2-[(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-1-benzimidazolyl]ethyl-diethylammonium IUPAC Name: 2-[2-[(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]benzimidazol-1-yl]ethyl-diethylazanium Traditional Name: 2-[2-[(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]benzimidazol-1-yl]ethyl-diethyl-ammonium Formula: C20H24BrN4O+ MolecularWeight: 416.33476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1NC=C3C=C(C=CC3=O)Br

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2N=C1NC=C3C=C(C=CC3=O)Br

InChI

InChI=1S/C20H23BrN4O/c1-3-24(4-2)11-12-25-18-8-6-5-7-17(18)23-20(25)22-14-15-13-16(21)9-10-19(15)26/h5-10,13-14H,3-4,11-12H2,1-2H3,(H,22,23)/p+1