3-(1H-benzimidazol-3-ium-2-yl)-2-[(3-bromophenyl)amino]chromen-7-one

Systemtic Name: 3-(1H-benzimidazol-3-ium-2-yl)-2-[(3-bromophenyl)amino]chromen-7-one Openeye Name: 3-(1H-benzimidazol-3-ium-2-yl)-2-(3-bromoanilino)chromen-7-one CAS Name: 3-(1H-benzimidazol-3-ium-2-yl)-2-(3-bromoanilino)-1-benzopyran-7-one IUPAC Name: 3-(1H-benzimidazol-3-ium-2-yl)-2-(3-bromoanilino)chromen-7-one Traditional Name: 3-(1H-benzimidazol-3-ium-2-yl)-2-(3-bromoanilino)chromen-7-one Formula: C22H15BrN3O2+ MolecularWeight: 433.2774

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=[NH+]2)C3=C(OC4=CC(=O)C=CC4=C3)NC5=CC(=CC=C5)Br

Isomeric SMILES

C1=CC=C2C(=C1)NC(=[NH+]2)C3=C(OC4=CC(=O)C=CC4=C3)NC5=CC(=CC=C5)Br

InChI

InChI=1S/C22H14BrN3O2/c23-14-4-3-5-15(11-14)24-22-17(10-13-8-9-16(27)12-20(13)28-22)21-25-18-6-1-2-7-19(18)26-21/h1-12,24H,(H,25,26)/p+1