(E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(5-nitropyridin-2-yl)oxy-phenyl]prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(5-nitropyridin-2-yl)oxy-phenyl]prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-[(5-nitro-2-pyridyl)oxy]phenyl]prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-[(5-nitro-2-pyridinyl)oxy]phenyl]-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-(5-nitropyridin-2-yl)oxyphenyl]prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-[3-methoxy-4-[(5-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=NC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3N2)OC4=NC=C(C=C4)[N+](=O)[O-]

InChI

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