2-[2-(1H-benzimidazol-2-yl)ethyl]-8-bromanyl-4-methyl-pyrrolo[3,4-c]quinoline-1,3-dione

Systemtic Name: 2-[2-(1H-benzimidazol-2-yl)ethyl]-8-bromanyl-4-methyl-pyrrolo[3,4-c]quinoline-1,3-dione Openeye Name: 2-[2-(1H-benzimidazol-2-yl)ethyl]-8-bromo-4-methyl-pyrrolo[3,4-c]quinoline-1,3-dione CAS Name: 2-[2-(1H-benzimidazol-2-yl)ethyl]-8-bromo-4-methylpyrrolo[3,4-c]quinoline-1,3-dione IUPAC Name: 2-[2-(1H-benzimidazol-2-yl)ethyl]-8-bromo-4-methylpyrrolo[3,4-c]quinoline-1,3-dione Traditional Name: 2-[2-(1H-benzimidazol-2-yl)ethyl]-8-bromo-4-methyl-pyrrolo[3,4-c]quinoline-1,3-quinone Formula: C21H15BrN4O2 MolecularWeight: 435.2734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C3C=C(C=CC3=N1)Br)C(=O)N(C2=O)CCC4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=C2C(=C3C=C(C=CC3=N1)Br)C(=O)N(C2=O)CCC4=NC5=CC=CC=C5N4

InChI

InChI=1S/C21H15BrN4O2/c1-11-18-19(13-10-12(22)6-7-14(13)23-11)21(28)26(20(18)27)9-8-17-24-15-4-2-3-5-16(15)25-17/h2-7,10H,8-9H2,1H3,(H,24,25)