5-chloranyl-2-[(E)-2-(1-phenylpyrazol-4-yl)ethenyl]-1,3-benzoxazole

Systemtic Name: 5-chloranyl-2-[(E)-2-(1-phenylpyrazol-4-yl)ethenyl]-1,3-benzoxazole Openeye Name: 5-chloro-2-[(E)-2-(1-phenylpyrazol-4-yl)vinyl]-1,3-benzoxazole CAS Name: 5-chloro-2-[(E)-2-(1-phenyl-4-pyrazolyl)ethenyl]-1,3-benzoxazole IUPAC Name: 5-chloro-2-[(E)-2-(1-phenylpyrazol-4-yl)ethenyl]-1,3-benzoxazole Traditional Name: 5-chloro-2-[(E)-2-(1-phenylpyrazol-4-yl)vinyl]-1,3-benzoxazole Formula: C18H12ClN3O MolecularWeight: 321.76038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=N2)C=CC3=NC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=N2)/C=C/C3=NC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C18H12ClN3O/c19-14-7-8-17-16(10-14)21-18(23-17)9-6-13-11-20-22(12-13)15-4-2-1-3-5-15/h1-12H/b9-6+