2-[4-(1H-benzimidazol-2-yl)phenyl]-1,3-benzoxazol-3-ium

Systemtic Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-1,3-benzoxazol-3-ium Openeye Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-1,3-benzoxazol-3-ium CAS Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-1,3-benzoxazol-3-ium IUPAC Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-1,3-benzoxazol-3-ium Traditional Name: 2-[4-(1H-benzimidazol-2-yl)phenyl]-1,3-benzoxazol-3-ium Formula: C20H14N3O+ MolecularWeight: 312.34466

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)C4=[NH+]C5=CC=CC=C5O4

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)C3=CC=C(C=C3)C4=[NH+]C5=CC=CC=C5O4

InChI

InChI=1S/C20H13N3O/c1-2-6-16-15(5-1)21-19(22-16)13-9-11-14(12-10-13)20-23-17-7-3-4-8-18(17)24-20/h1-12H,(H,21,22)/p+1