(E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(3-nitropyridin-2-yl)oxy-phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(3-nitropyridin-2-yl)oxy-phenyl]prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-[(3-nitro-2-pyridyl)oxy]phenyl]prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-[(3-nitro-2-pyridinyl)oxy]phenyl]-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(3-nitropyridin-2-yl)oxyphenyl]prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-[(3-nitro-2-pyridyl)oxy]phenyl]acrylonitrile Formula: C22H15N5O4 MolecularWeight: 413.3856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OC4=C(C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3N2)OC4=C(C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C22H15N5O4/c1-30-20-12-14(8-9-19(20)31-22-18(27(28)29)7-4-10-24-22)11-15(13-23)21-25-16-5-2-3-6-17(16)26-21/h2-12H,1H3,(H,25,26)/b15-11+