5-azanyl-2-[4-(1H-benzimidazol-2-yl)phenyl]isoindole-1,3-dione

Systemtic Name: 5-azanyl-2-[4-(1H-benzimidazol-2-yl)phenyl]isoindole-1,3-dione Openeye Name: 5-amino-2-[4-(1H-benzimidazol-2-yl)phenyl]isoindoline-1,3-dione CAS Name: 5-amino-2-[4-(1H-benzimidazol-2-yl)phenyl]isoindole-1,3-dione IUPAC Name: 5-amino-2-[4-(1H-benzimidazol-2-yl)phenyl]isoindole-1,3-dione Traditional Name: 5-amino-2-[4-(1H-benzimidazol-2-yl)phenyl]isoindoline-1,3-quinone Formula: C21H14N4O2 MolecularWeight: 354.36146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)N

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)N4C(=O)C5=C(C4=O)C=C(C=C5)N

InChI

InChI=1S/C21H14N4O2/c22-13-7-10-15-16(11-13)21(27)25(20(15)26)14-8-5-12(6-9-14)19-23-17-3-1-2-4-18(17)24-19/h1-11H,22H2,(H,23,24)