4-(1H-benzimidazol-2-yl)quinoline hydrate

Systemtic Name: 4-(1H-benzimidazol-2-yl)quinoline hydrate Openeye Name: 4-(1H-benzimidazol-2-yl)quinoline hydrate CAS Name: 4-(1H-benzimidazol-2-yl)quinoline hydrate IUPAC Name: 4-(1H-benzimidazol-2-yl)quinoline hydrate Traditional Name: 4-(1H-benzimidazol-2-yl)quinoline hydrate Formula: C16H13N3O MolecularWeight: 263.29392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)C3=NC4=CC=CC=C4N3.O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)C3=NC4=CC=CC=C4N3.O

InChI

InChI=1S/C16H11N3.H2O/c1-2-6-13-11(5-1)12(9-10-17-13)16-18-14-7-3-4-8-15(14)19-16;/h1-10H,(H,18,19);1H2