(E)-2-(1H-benzimidazol-2-yl)-3-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-(2-oxidanylidenechromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-(2-oxochromen-3-yl)-1-phenyl-pyrazol-4-yl]prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-(2-oxo-1-benzopyran-3-yl)-1-phenyl-4-pyrazolyl]-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-(2-oxochromen-3-yl)-1-phenylpyrazol-4-yl]prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-(2-ketochromen-3-yl)-1-phenyl-pyrazol-4-yl]acrylonitrile Formula: C28H17N5O2 MolecularWeight: 455.46688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4OC3=O)C=C(C#N)C5=NC6=CC=CC=C6N5

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4OC3=O)/C=C(\C#N)/C5=NC6=CC=CC=C6N5

InChI

InChI=1S/C28H17N5O2/c29-16-19(27-30-23-11-5-6-12-24(23)31-27)14-20-17-33(21-9-2-1-3-10-21)32-26(20)22-15-18-8-4-7-13-25(18)35-28(22)34/h1-15,17H,(H,30,31)/b19-14+